| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 50 | Low | 47.8 | Very low | 223 Ų | 223 | 144.5 Ų | 144.5 | 100% | 1.099 | 80% | 0.803 | S | S | * | * | 0 | 92.7 | 0 | -173.3 | 171.4 | 157.1 | 0 | 0 | 106.8 | |||||
| 2 | V | 42.7 | Very low | 47.4 | Very low | 130 Ų | 130 | 143.8 Ų | 143.8 | 79% | 0.788 | 80% | 0.797 | S | S | * | * | trans | -113.3 | 111.6 | -177.8 | 178.4 | 0 | 0 | 0 | 0 | 105.6 | L4 | V2-L4 HydrophobicContact CG1-CD2 4.48Å; V2-L4 PolarHBondContact O-N 3.43Å | ||
| 3 | I | 47.8 | Very low | 47.7 | Very low | 147 Ų | 147 | 142.2 Ų | 142.2 | 75% | 0.754 | 80% | 0.797 | S | S | * | * | trans | -83.9 | 106.9 | 179.9 | -60.1 | 173.3 | 0 | 0 | 0 | 106.1 | ||||
| 4 | L | 50 | Low | 47.4 | Very low | 140 Ų | 140 | 143.9 Ų | 143.9 | 73% | 0.733 | 79% | 0.792 | S | S | * | * | trans | -80.9 | 135.6 | 173.1 | -69.3 | 173.2 | 0 | 0 | 0 | 109.4 | V2 V6 | V2-L4 HydrophobicContact CG1-CD2 4.48Å; V2-L4 PolarHBondContact O-N 3.43Å; L4-V6 PolarHBondContact O-N 2.83Å | ||
| 5 | P | 47.1 | Very low | 47.1 | Very low | 112 Ų | 112 | 142 Ų | 142 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -70 | 128.8 | -179.7 | 27.6 | -32.2 | 0 | 0 | 0 | 110.7 | E7 | P5-E7 PolarHBondContact O-N 2.82Š| ||
| 6 | V | 56.6 | Low | 46.9 | Very low | 127 Ų | 127 | 146.4 Ų | 146.4 | 77% | 0.77 | 79% | 0.792 | S | S | * | * | trans | -76.4 | 103.2 | 172.6 | 177.3 | 0 | 0 | 0 | 0 | 107.5 | L4 F8 | L4-V6 PolarHBondContact O-N 2.83Å; V6-F8 PolarHBondContact O-N 3.13Å | ||
| 7 | E | 47.3 | Very low | 46.7 | Very low | 183 Ų | 183 | 151.3 Ų | 151.3 | 86% | 0.855 | 80% | 0.799 | S | S | * | * | trans | -68.9 | 113.6 | 170.2 | -72.5 | -167 | 158.9 | 0 | 0 | 109.5 | P5 S9 | P5-E7 PolarHBondContact O-N 2.82Å; E7-S9 PolarHBondContact O-N 2.82Å | ||
| 8 | F | 43.5 | Very low | 46.5 | Very low | 199 Ų | 199 | 149.6 Ų | 149.6 | 87% | 0.873 | 79% | 0.79 | S | S | * | * | trans | -72 | 103.8 | 174.5 | -123.7 | -98.4 | 0 | 0 | 0 | 108.6 | V6 S10 | V6-F8 PolarHBondContact O-N 3.13Å; F8-S10 PolarHBondContact O-N 2.94Å; F8-S10 VanDerWaalsContact O-N 3.15Å | ||
| 9 | S | 46.8 | Very low | 46.5 | Very low | 113 Ų | 113 | 149.5 Ų | 149.5 | 79% | 0.79 | 79% | 0.79 | S | S | * | * | trans | -70.6 | 104.3 | 172.5 | -165.8 | 0 | 0 | 0 | 0 | 109 | E7 | E7-S9 PolarHBondContact O-N 2.82Š| ||
| 10 | S | 44.9 | Very low | 46.2 | Very low | 101 Ų | 101 | 153.6 Ų | 153.6 | 71% | 0.706 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 127 | 173.3 | -170.3 | 0 | 0 | 0 | 0 | 109 | F8 D12 | F8-S10 PolarHBondContact O-N 2.94Å; F8-S10 VanDerWaalsContact O-N 3.15Å; S10-D12 PolarHBondContact O-N 3.46Å |
| 11 | P | 49.5 | Very low | 46.1 | Very low | 114 Ų | 114 | 156.9 Ų | 156.9 | 74% | 0.74 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 120.4 | -176.4 | 26.4 | -31.6 | 0 | 0 | 0 | 111.2 | P13 | P11-P13 WeakPolarHBondContact O-CD 3.3Š|
| 12 | D | 43 | Very low | 45.9 | Very low | 136 Ų | 136 | 152 Ų | 152 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 124 | 173 | -77.9 | -44.4 | 0 | 0 | 0 | 111.9 | S10 F14 | S10-D12 PolarHBondContact O-N 3.46Å; D12-F14 HydrophobicContact CB-CD2 4.07Å; D12-F14 PolarHBondContact O-N 3.32Å; D12-F14 VanDerWaalsContact O-N 3.13Å |
| 13 | P | 51.5 | Low | 46.5 | Very low | 124 Ų | 124 | 152.5 Ų | 152.5 | 81% | 0.805 | 78% | 0.784 | S | S | * | * | trans | -85.5 | 76.1 | 171.1 | 33.1 | -31 | 0 | 0 | 0 | 110.4 | P11 C15 | P11-P13 WeakPolarHBondContact O-CD 3.3Å; P13-C15 PolarHBondContact O-N 3.48Å | ||
| 14 | F | 42.7 | Very low | 46.7 | Very low | 165 Ų | 165 | 154.6 Ų | 154.6 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | trans | -85.4 | 80.8 | 166.9 | -93.3 | -80.9 | 0 | 0 | 0 | 110.6 | D12 | D12-F14 HydrophobicContact CB-CD2 4.07Å; D12-F14 PolarHBondContact O-N 3.32Å; D12-F14 VanDerWaalsContact O-N 3.13Å | ||
| 15 | C | 43.6 | Very low | 46.5 | Very low | 116 Ų | 116 | 155.9 Ų | 155.9 | 78% | 0.784 | 80% | 0.796 | S | S | * | * | trans | -97.6 | 87.7 | 159.9 | -69.9 | 0 | 0 | 0 | 0 | 108.9 | P13 Y17 | P13-C15 PolarHBondContact O-N 3.48Å; C15-Y17 PolarHBondContact O-N 3.2Å | ||
| 16 | R | 43.6 | Very low | 46.2 | Very low | 212 Ų | 212 | 153.9 Ų | 153.9 | 80% | 0.8 | 80% | 0.796 | S | S | * | * | trans | -75 | 101.5 | 160.8 | -84.6 | -171.9 | 175.4 | 170.2 | -1.7 | 108.3 | ||||
| 17 | Y | 44.2 | Very low | 45.2 | Very low | 230 Ų | 230 | 156.1 Ų | 156.1 | 90% | 0.902 | 80% | 0.798 | S | S | * | * | trans | -97.6 | 88.9 | 157.2 | -103.7 | -89.6 | 0 | 0 | 0 | 107.4 | C15 | C15-Y17 PolarHBondContact O-N 3.2Š| ||
| 18 | D | 41.6 | Very low | 45 | Very low | 121 Ų | 121 | 155.4 Ų | 155.4 | 65% | 0.647 | 80% | 0.798 | S | S | * | * | trans | -105 | 110.4 | 160.8 | -106.4 | -44 | 0 | 0 | 0 | 106 | ||||
| 19 | D | 46.4 | Very low | 44.9 | Very low | 147 Ų | 147 | 152.9 Ų | 152.9 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | trans | -159.8 | 92 | 146.8 | -108.2 | -19.3 | 0 | 0 | 0 | 109.7 | R21 | D19-R21 PolarHBondContact O-N 3.29Š| ||
| 20 | R | 42 | Very low | 44.6 | Very low | 232 Ų | 232 | 156 Ų | 156 | 88% | 0.875 | 79% | 0.792 | S | S | * | * | trans | -58.8 | 119.5 | 162.7 | -64.1 | 175.1 | 177 | -168.2 | -3.2 | 108.4 | ||||
| 21 | R | 43.1 | Very low | 44.4 | Very low | 222 Ų | 222 | 159.3 Ų | 159.3 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | trans | -121.5 | 126.4 | 152.7 | -71.1 | -164.2 | -170.5 | -151.7 | 4 | 109.7 | D19 | D19-R21 PolarHBondContact O-N 3.29Š| ||
| 22 | P | 47.1 | Very low | 43.9 | Very low | 120 Ų | 120 | 161.9 Ų | 161.9 | 78% | 0.779 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 124.6 | -176.6 | 30.7 | -32.1 | 0 | 0 | 0 | 109.8 | K24 | P22-K24 PolarHBondContact O-N 3.42Š|
| 23 | V | 54.6 | Low | 43.7 | Very low | 141 Ų | 141 | 161.1 Ų | 161.1 | 86% | 0.855 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 119.2 | 165.5 | 178.2 | 0 | 0 | 0 | 0 | 106.8 | ||
| 24 | K | 51.4 | Low | 43.2 | Very low | 191 Ų | 191 | 159.9 Ų | 159.9 | 83% | 0.83 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 134.5 | -179.7 | -67.8 | 178.3 | 175.3 | -178.8 | 0 | 110.3 | P22 | P22-K24 PolarHBondContact O-N 3.42Š|
| 25 | D | 46.8 | Very low | 43 | Very low | 168 Ų | 168 | 163.6 Ų | 163.6 | 90% | 0.898 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 143.2 | 166.5 | -59.5 | -62.4 | 0 | 0 | 0 | 111.7 | ||
| 26 | G | 39.4 | Very low | 42.7 | Very low | 70 Ų | 70 | 170.1 Ų | 170.1 | 72% | 0.722 | 83% | 0.826 | S | S | * | * | trans | 120.3 | 93.4 | 159.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 27 | E | 37.3 | Very low | 42.4 | Very low | 174 Ų | 174 | 163.9 Ų | 163.9 | 81% | 0.813 | 83% | 0.827 | S | S | * | * | -174.1 | 101.7 | 115 | -101.1 | -179.8 | 168.1 | 0 | 0 | 109.8 | L29 | E27-L29 VanDerWaalsContact C-N 3.35Å; E27-L29 PolarHBondContact O-N 3.42Å; E27-L29 VanDerWaalsContact O-N 3.09Å | |||
| 28 | I | 42.7 | Very low | 41.9 | Very low | 168 Ų | 168 | 156.9 Ų | 156.9 | 86% | 0.862 | 83% | 0.825 | S | S | * | * | trans | -75.7 | 88.4 | 170.1 | -60.6 | 168.9 | 0 | 0 | 0 | 106.6 | K30 | I28-K30 PolarHBondContact O-N 3.27Š| ||
| 29 | L | 40.5 | Very low | 41.8 | Very low | 146 Ų | 146 | 155.9 Ų | 155.9 | 76% | 0.764 | 83% | 0.834 | S | S | * | * | trans | -83.7 | 105.5 | 169.4 | -84 | 166.1 | 0 | 0 | 0 | 109.9 | E27 L31 | E27-L29 VanDerWaalsContact C-N 3.35Å; E27-L29 PolarHBondContact O-N 3.42Å; E27-L29 VanDerWaalsContact O-N 3.09Å; L29-L31 PolarHBondContact O-N 2.88Å; L29-L31 VanDerWaalsContact O-N 3.11Å | ||
| 30 | K | 40.6 | Very low | 41.3 | Very low | 177 Ų | 177 | 153.7 Ų | 153.7 | 77% | 0.77 | 84% | 0.836 | S | S | * | * | trans | -50 | 104.5 | 168.4 | -70 | 170.2 | 175.2 | 172.2 | 0 | 110.9 | I28 H32 | I28-K30 PolarHBondContact O-N 3.27Å; K30-H32 PolarHBondContact O-N 3.3Å | ||
| 31 | L | 40.6 | Very low | 41.1 | Very low | 172 Ų | 172 | 150.4 Ų | 150.4 | 90% | 0.901 | 84% | 0.835 | S | S | * | * | trans | -81.1 | 97 | 163.4 | -93.1 | 154.7 | 0 | 0 | 0 | 109 | L29 S33 | L29-L31 PolarHBondContact O-N 2.88Å; L29-L31 VanDerWaalsContact O-N 3.11Å; L31-S33 PolarHBondContact O-N 3.48Å | ||
| 32 | H | 38.6 | Very low | 40.7 | Very low | 167 Ų | 167 | 147.7 Ų | 147.7 | 77% | 0.773 | 84% | 0.837 | S | S | * | * | trans | -61.2 | 115.7 | 167.7 | -97.1 | -89.2 | 0 | 0 | 0 | 110.2 | K30 A34 | K30-H32 PolarHBondContact O-N 3.3Å; H32-A34 PolarHBondContact O-N 3.37Å | ||
| 33 | S | 38.7 | Very low | 40.3 | Very low | 120 Ų | 120 | 149.5 Ų | 149.5 | 84% | 0.839 | 84% | 0.839 | S | S | * | * | trans | -70 | 98.1 | 165.3 | 53.8 | 0 | 0 | 0 | 0 | 110.1 | L31 | L31-S33 PolarHBondContact O-N 3.48Š| ||
| 34 | A | 41.5 | Very low | 39.4 | Very low | 98 Ų | 98 | 153.9 Ų | 153.9 | 81% | 0.81 | 84% | 0.84 | S | S | * | * | trans | -98.2 | 124.6 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | H32 | H32-A34 PolarHBondContact O-N 3.37Š| ||
| 35 | R | 37.7 | Very low | 39.2 | Very low | 243 Ų | 243 | 150.3 Ų | 150.3 | 92% | 0.917 | 84% | 0.836 | S | S | * | * | trans | -65.4 | 139.2 | -174.1 | -80.7 | 174 | 168.5 | -169.9 | -3.3 | 113.5 | ||||
| 36 | R | 38.7 | Very low | 38.7 | Very low | 253 Ų | 253 | 148.2 Ų | 148.2 | 96% | 0.955 | 84% | 0.835 | S | S | * | * | trans | 11.1 | 106.2 | 136.8 | -61.2 | -178.7 | -161.2 | -155.4 | 2.4 | 116.4 | ||||
| 37 | G | 35.8 | Very low | 38.3 | Very low | 81 Ų | 81 | 149.5 Ų | 149.5 | 84% | 0.835 | 84% | 0.838 | S | S | * | * | trans | -124.3 | 103.9 | 151.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 38 | G | 34.6 | Very low | 38 | Very low | 84 Ų | 84 | 145.4 Ų | 145.4 | 87% | 0.866 | 84% | 0.835 | S | S | * | * | trans | -81.3 | 132.9 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 39 | A | 38.7 | Very low | 37.3 | Very low | 99 Ų | 99 | 146.6 Ų | 146.6 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | trans | -138.9 | 118.8 | 161.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 40 | A | 36.8 | Very low | 36.7 | Very low | 101 Ų | 101 | 143.3 Ų | 143.3 | 84% | 0.835 | 84% | 0.84 | S | S | * | * | trans | -66.5 | 131.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 41 | L | 37.7 | Very low | 36.1 | Very low | 163 Ų | 163 | 138.9 Ų | 138.9 | 85% | 0.853 | 84% | 0.836 | S | S | * | * | trans | -134.7 | 107.3 | 158.7 | -83.2 | 171.9 | 0 | 0 | 0 | 108.7 | I43 | L41-I43 PolarHBondContact O-N 3.32Š| ||
| 42 | D | 35.2 | Very low | 35.5 | Very low | 165 Ų | 165 | 138.7 Ų | 138.7 | 88% | 0.882 | 84% | 0.836 | S | S | * | * | trans | -57.9 | 118 | 162.4 | -95 | -43.5 | 0 | 0 | 0 | 109.9 | ||||
| 43 | I | 38.4 | Very low | 35.1 | Very low | 159 Ų | 159 | 135.1 Ų | 135.1 | 82% | 0.815 | 84% | 0.835 | S | S | * | * | trans | -135.2 | 108.9 | 157 | -58.7 | -178 | 0 | 0 | 0 | 107.9 | L41 | L41-I43 PolarHBondContact O-N 3.32Š| ||
| 44 | R | 34.4 | Very low | 35 | Very low | 232 Ų | 232 | 138 Ų | 138 | 88% | 0.875 | 84% | 0.835 | S | S | * | * | trans | -72.8 | 165.4 | 170.7 | -114.7 | -169.8 | 155.9 | -177.1 | -4.5 | 111.1 | ||||
| 45 | P | 48.1 | Very low | 34.9 | Very low | 116 Ų | 116 | 138.8 Ų | 138.8 | 75% | 0.753 | 83% | 0.832 | S | S | * | * | trans | -90.8 | 150.2 | -147.7 | 36.1 | -37.6 | 0 | 0 | 0 | 114 | ||||
| 46 | S | 36.6 | Very low | 35.1 | Very low | 124 Ų | 124 | 132.1 Ų | 132.1 | 87% | 0.867 | 83% | 0.829 | S | S | * | * | trans | -110.6 | 112.8 | 159.6 | -170.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 47 | A | 30.3 | Very low | 35.4 | Very low | 97 Ų | 97 | 125.2 Ų | 125.2 | 80% | 0.802 | 82% | 0.815 | S | S | * | * | trans | -81.7 | 129.9 | 166.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 48 | A | 31.5 | Very low | 36.1 | Very low | 89 Ų | 89 | 132.5 Ų | 132.5 | 74% | 0.736 | 82% | 0.817 | S | S | * | * | trans | -174.3 | 108 | 148.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 49 | M | 27.3 | Very low | 36.9 | Very low | 192 Ų | 192 | 130.8 Ų | 130.8 | 95% | 0.946 | 80% | 0.8 | S | S | * | * | 63 | 121.5 | 123.2 | -72.9 | -93 | -83.6 | 0 | 0 | 121.2 | |||||
| 50 | G | 28.1 | Very low | 37.4 | Very low | 77 Ų | 77 | 135 Ų | 135 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | trans | 94.9 | 142 | 142.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 51 | A | 28.9 | Very low | 38.6 | Very low | 84 Ų | 84 | 135.7 Ų | 135.7 | 69% | 0.694 | 78% | 0.78 | S | S | * | * | cis | -178.3 | 158.1 | -10.3 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 52 | L | 27.8 | Very low | 39.6 | Very low | 169 Ų | 169 | 134.7 Ų | 134.7 | 89% | 0.885 | 77% | 0.771 | S | S | * | * | trans | 80.9 | 131.5 | 152.1 | -72.9 | 147.6 | 0 | 0 | 0 | 120.8 | ||||
| 53 | A | 30.6 | Very low | 40.6 | Very low | 91 Ų | 91 | 134.7 Ų | 134.7 | 75% | 0.752 | 76% | 0.759 | S | S | * | * | trans | 83.9 | 126.5 | 147.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 54 | E | 35.9 | Very low | 42.2 | Very low | 182 Ų | 182 | 132.6 Ų | 132.6 | 85% | 0.85 | 74% | 0.744 | S | S | * | * | cis | -159.6 | 165.1 | 16.7 | -91.5 | -147.1 | 120.9 | 0 | 0 | 110.6 | ||||
| 55 | P | 40.1 | Very low | 44 | Very low | 114 Ų | 114 | 127.6 Ų | 127.6 | 74% | 0.74 | 73% | 0.734 | S | S | * | * | trans | -92.4 | 120.7 | -176 | 34.8 | -28.1 | 0 | 0 | 0 | 113 | ||||
| 56 | A | 41.7 | Very low | 45 | Very low | 103 Ų | 103 | 128.2 Ų | 128.2 | 85% | 0.851 | 72% | 0.721 | S | S | * | * | trans | -133.2 | 59.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 57 | T | 45.6 | Very low | 46.1 | Very low | 107 Ų | 107 | 128.6 Ų | 128.6 | 66% | 0.656 | 70% | 0.704 | S | S | * | * | trans | -117.3 | 2.2 | 177.5 | 51.8 | 0 | 0 | 0 | 0 | 114.6 | G59 R60 | T57-G59 VanDerWaalsContact C-N 3.26Å; T57-G59 PolarHBondContact O-N 3.16Å; T57-R60 PolarHBondContact O-N 3.48Å | ||
| 58 | R | 49.9 | Very low | 48.1 | Very low | 234 Ų | 234 | 126.5 Ų | 126.5 | 88% | 0.883 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -66.5 | -21.7 | -173.9 | -146 | 174.7 | -168.1 | 173.2 | 3 | 114.7 | ||
| 59 | G | 51.1 | Low | 49.8 | Very low | 49 Ų | 49 | 130.3 Ų | 130.3 | 51% | 0.505 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -84.1 | -17.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | T57 | T57-G59 VanDerWaalsContact C-N 3.26Å; T57-G59 PolarHBondContact O-N 3.16Å |
| 60 | R | 49.6 | Very low | 51.2 | Low | 188 Ų | 188 | 129.2 Ų | 129.2 | 71% | 0.709 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -82.4 | -28.4 | -170.4 | -159.6 | -178.2 | -79.2 | -126.7 | 3.5 | 113 | T57 | T57-R60 PolarHBondContact O-N 3.48Å |
| 61 | E | 61.8 | Low | 53 | Low | 115 Ų | 115 | 129.7 Ų | 129.7 | 54% | 0.537 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -79.1 | -36.9 | -178.9 | -69.7 | -71.3 | 118.1 | 0 | 0 | 112.5 | W63 K64 L65 | E61-W63 VanDerWaalsContact C-N 3.32Å; E61-W63 PolarHBondContact O-N 3.33Å; E61-K64 PolarHBondContact O-N 3.24Å; E61-K64 IonicContact OE1-NZ 2.86Å; E61-K64 PolarHBondContact OE1-NZ 3.12Å; E61-L65 PolarHBondContact O-N 3.25Å |
| 62 | E | 59.2 | Low | 54.3 | Low | 142 Ų | 142 | 132.4 Ų | 132.4 | 66% | 0.664 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -64.5 | -36.7 | 177.1 | -69.8 | -173.4 | 164.2 | 0 | 0 | 112.2 | K64 L65 W66 | E62-K64 VanDerWaalsContact C-N 3.32Å; E62-K64 PolarHBondContact O-N 3.38Å; E62-L65 PolarHBondContact O-N 3.45Å; E62-W66 PolarHBondContact O-N 2.93Å |
| 63 | W | 55.3 | Low | 55 | Low | 164 Ų | 164 | 127.7 Ų | 127.7 | 62% | 0.621 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -67.2 | -28.6 | 175.5 | -90.2 | 90.8 | 0 | 0 | 0 | 113.7 | E61 W66 R67 | E61-W63 VanDerWaalsContact C-N 3.32Å; E61-W63 PolarHBondContact O-N 3.33Å; W63-W66 HydrophobicContact CZ3-CE3 4.41Å; W63-R67 PolarHBondContact O-N 3.48Å |
| 64 | K | 71.6 | Confident | 55.8 | Low | 115 Ų | 115 | 128.7 Ų | 128.7 | 50% | 0.5 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -71 | -42.3 | 173.5 | -70.1 | 176.1 | -176.4 | 171.5 | 0 | 111 | E61 E62 R67 A68 | E61-K64 PolarHBondContact O-N 3.24Å; E61-K64 IonicContact OE1-NZ 2.86Å; E61-K64 PolarHBondContact OE1-NZ 3.12Å; E62-K64 VanDerWaalsContact C-N 3.32Å; E62-K64 PolarHBondContact O-N 3.38Å; K64-R67 PolarHBondContact O-N 2.96Å; K64-A68 PolarHBondContact O-N 3.28Å |
| 65 | L | 72.8 | Confident | 56 | Low | 128 Ų | 128 | 122.9 Ų | 122.9 | 67% | 0.67 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -65.5 | -41.1 | 177.8 | -68.9 | 172.9 | 0 | 0 | 0 | 112.1 | E61 E62 R67 A68 W69 | E61-L65 PolarHBondContact O-N 3.25Å; E62-L65 PolarHBondContact O-N 3.45Å; L65-R67 VanDerWaalsContact C-N 3.33Å; L65-R67 PolarHBondContact O-N 3.07Å; L65-A68 PolarHBondContact O-N 3.08Å; L65-W69 PolarHBondContact O-N 3.18Å |
| 66 | W | 68.4 | Low | 55.9 | Low | 128 Ų | 128 | 122.8 Ų | 122.8 | 49% | 0.485 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -63.3 | -37.9 | 176.3 | -168.9 | 84.1 | 0 | 0 | 0 | 112.3 | E62 W63 R70 | E62-W66 PolarHBondContact O-N 2.93Å; W63-W66 HydrophobicContact CZ3-CE3 4.41Å; W66-R70 PolarHBondContact O-N 3.5Å |
| 67 | R | 61.4 | Low | 56 | Low | 132 Ų | 132 | 123.4 Ų | 123.4 | 50% | 0.498 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -68.1 | -44.4 | 174.2 | -88.1 | -163.9 | -100.5 | -177.1 | -4.1 | 113 | W63 K64 L65 W69 R70 S71 E260 | W63-R67 PolarHBondContact O-N 3.48Å; K64-R67 PolarHBondContact O-N 2.96Å; L65-R67 VanDerWaalsContact C-N 3.33Å; L65-R67 PolarHBondContact O-N 3.07Å; R67-W69 VanDerWaalsContact C-N 3.26Å; R67-W69 PolarHBondContact O-N 3.09Å; R67-R70 PolarHBondContact O-N 3.41Å; R67-R70 VanDerWaalsContact O-N 3.16Å; R67-S71 PolarHBondContact O-N 3.41Å; R67-S71 VanDerWaalsContact O-N 3.16Å; R67-S71 PolarHBondContact O-OG 3.39Å; R67-E260 IonicContact CZ-OE1 3.36Å; R67-E260 IonicContact NH1-OE1 2.78Å; R67-E260 PolarHBondContact NH1-OE1 3.15Å |
| 68 | A | 71.8 | Confident | 55.6 | Low | 53 Ų | 53 | 128.4 Ų | 128.4 | 44% | 0.438 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -59.3 | -39.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | K64 L65 S71 L72 | K64-A68 PolarHBondContact O-N 3.28Å; L65-A68 PolarHBondContact O-N 3.08Å; A68-S71 PolarHBondContact O-N 2.95Å; A68-L72 VanDerWaalsContact O-CD1 3.3Å; A68-L72 WeakPolarHBondContact O-CD1 3.46Å; A68-L72 PolarHBondContact O-N 3.5Å |
| 69 | W | 67.7 | Low | 54.8 | Low | 169 Ų | 169 | 123.9 Ų | 123.9 | 64% | 0.64 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -64.5 | -40 | 176.1 | -172.1 | 77.5 | 0 | 0 | 0 | 112.6 | L65 R67 S71 L72 S73 | L65-W69 PolarHBondContact O-N 3.18Å; R67-W69 VanDerWaalsContact C-N 3.26Å; R67-W69 PolarHBondContact O-N 3.09Å; W69-S71 VanDerWaalsContact C-N 3.33Å; W69-S71 PolarHBondContact O-N 3.1Å; W69-L72 PolarHBondContact O-N 3.42Å; W69-S73 PolarHBondContact O-N 2.91Å |
| 70 | R | 56 | Low | 54.3 | Low | 170 Ų | 170 | 127.7 Ų | 127.7 | 64% | 0.642 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -65 | -35 | 177.9 | -136.7 | -178.2 | -157.1 | -135.9 | 4.7 | 112.8 | W66 R67 L72 | W66-R70 PolarHBondContact O-N 3.5Å; R67-R70 PolarHBondContact O-N 3.41Å; R67-R70 VanDerWaalsContact O-N 3.16Å; R70-L72 VanDerWaalsContact C-N 3.33Å |
| 71 | S | 65.1 | Low | 53.6 | Low | 87 Ų | 87 | 126.4 Ų | 126.4 | 61% | 0.608 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -71.5 | -25.3 | 175.4 | -60.5 | 0 | 0 | 0 | 0 | 113.3 | R67 A68 W69 | R67-S71 PolarHBondContact O-N 3.41Å; R67-S71 VanDerWaalsContact O-N 3.16Å; R67-S71 PolarHBondContact O-OG 3.39Å; A68-S71 PolarHBondContact O-N 2.95Å; W69-S71 VanDerWaalsContact C-N 3.33Å; W69-S71 PolarHBondContact O-N 3.1Å |
| 72 | L | 57.9 | Low | 52.2 | Low | 141 Ų | 141 | 125.9 Ų | 125.9 | 74% | 0.738 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -88 | -11.7 | -179.8 | -96.4 | 83.3 | 0 | 0 | 0 | 114.6 | A68 W69 R70 P74 | A68-L72 VanDerWaalsContact O-CD1 3.3Å; A68-L72 WeakPolarHBondContact O-CD1 3.46Å; A68-L72 PolarHBondContact O-N 3.5Å; W69-L72 PolarHBondContact O-N 3.42Å; R70-L72 VanDerWaalsContact C-N 3.33Å; L72-P74 VanDerWaalsContact C-CD 3.47Å; L72-P74 WeakPolarHBondContact O-CD 3.42Å |
| 73 | S | 41.3 | Very low | 50.7 | Low | 69 Ų | 69 | 125.7 Ų | 125.7 | 48% | 0.483 | 67% | 0.674 | S | S | . | * | trans | -122.3 | 76.5 | 177.4 | -76.8 | 0 | 0 | 0 | 0 | 111.2 | W69 G75 | W69-S73 PolarHBondContact O-N 2.91Å; S73-G75 PolarHBondContact O-N 3.22Å | ||
| 74 | P | 47.4 | Very low | 49.7 | Very low | 113 Ų | 113 | 121.9 Ų | 121.9 | 73% | 0.734 | 68% | 0.677 | S | S | * | * | trans | -62.7 | 105.5 | 159.1 | 26.8 | -29.3 | 0 | 0 | 0 | 106.9 | L72 | L72-P74 VanDerWaalsContact C-CD 3.47Å; L72-P74 WeakPolarHBondContact O-CD 3.42Å | ||
| 75 | G | 41.1 | Very low | 47.9 | Very low | 59 Ų | 59 | 123.4 Ų | 123.4 | 61% | 0.608 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 144 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | S73 | S73-G75 PolarHBondContact O-N 3.22Š|
| 76 | P | 38.1 | Very low | 46 | Very low | 113 Ų | 113 | 124.5 Ų | 124.5 | 73% | 0.734 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 140.9 | -173.6 | 24.1 | -32.5 | 0 | 0 | 0 | 110.5 | F78 | P76-F78 PolarHBondContact O-N 3.01Š|
| 77 | P | 43.2 | Very low | 44.3 | Very low | 115 Ų | 115 | 123.1 Ų | 123.1 | 75% | 0.747 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 123 | 176.4 | 25.3 | -32.3 | 0 | 0 | 0 | 108.6 | L79 | P77-L79 PolarHBondContact O-N 3.45Š|
| 78 | F | 37.8 | Very low | 42.9 | Very low | 212 Ų | 212 | 128.4 Ų | 128.4 | 93% | 0.93 | 73% | 0.732 | S | S | * | * | trans | -54.7 | 100.7 | 173.6 | -81.3 | -93.3 | 0 | 0 | 0 | 109.4 | P76 | P76-F78 PolarHBondContact O-N 3.01Š| ||
| 79 | L | 33.2 | Very low | 41.1 | Very low | 140 Ų | 140 | 134.1 Ų | 134.1 | 73% | 0.733 | 75% | 0.749 | S | S | * | * | trans | -79.6 | 132.9 | 159.2 | -74.7 | 169.9 | 0 | 0 | 0 | 107.6 | P77 L81 | P77-L79 PolarHBondContact O-N 3.45Å; L79-L81 PolarHBondContact O-N 3.49Å | ||
| 80 | P | 39.3 | Very low | 39.5 | Very low | 129 Ų | 129 | 133.5 Ų | 133.5 | 84% | 0.838 | 76% | 0.758 | S | S | * | * | trans | -78.1 | 93.5 | -179.3 | 32 | -30.4 | 0 | 0 | 0 | 108 | ||||
| 81 | L | 34.9 | Very low | 38.3 | Very low | 160 Ų | 160 | 131 Ų | 131 | 84% | 0.838 | 77% | 0.766 | S | S | * | * | trans | -91.4 | 121.7 | 171.6 | -85.2 | 159.1 | 0 | 0 | 0 | 109.8 | L79 | L79-L81 PolarHBondContact O-N 3.49Š| ||
| 82 | S | 33.3 | Very low | 36.7 | Very low | 104 Ų | 104 | 132 Ų | 132 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -52.1 | 148.8 | -177.6 | 55.1 | 0 | 0 | 0 | 0 | 114.8 | A84 | S82-A84 PolarHBondContact O-N 3.09Š| ||
| 83 | C | 27.8 | Very low | 35.4 | Very low | 139 Ų | 139 | 130.6 Ų | 130.6 | 94% | 0.939 | 77% | 0.773 | S | S | * | * | trans | -22.1 | 110.6 | 164 | -61.4 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 84 | A | 32.8 | Very low | 34.8 | Very low | 83 Ų | 83 | 134.2 Ų | 134.2 | 69% | 0.686 | 79% | 0.788 | S | S | * | * | trans | -133.6 | 102.2 | 150.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | S82 L86 | S82-A84 PolarHBondContact O-N 3.09Å; A84-L86 PolarHBondContact O-N 2.94Å | ||
| 85 | T | 34.3 | Very low | 34.1 | Very low | 148 Ų | 148 | 136.8 Ų | 136.8 | 91% | 0.908 | 80% | 0.795 | S | S | * | * | trans | -48.7 | 101.3 | 167.6 | 32.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 86 | L | 32.7 | Very low | 33.8 | Very low | 150 Ų | 150 | 143.1 Ų | 143.1 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | -114.5 | 103.2 | 162.2 | -83.7 | 162.3 | 0 | 0 | 0 | 108 | A84 W88 | A84-L86 PolarHBondContact O-N 2.94Å; L86-W88 PolarHBondContact O-N 2.96Å | ||
| 87 | S | 32.8 | Very low | 33.6 | Very low | 100 Ų | 100 | 146.4 Ų | 146.4 | 70% | 0.699 | 82% | 0.819 | S | S | * | * | trans | -43.3 | 114.4 | 170.4 | 169.8 | 0 | 0 | 0 | 0 | 111.1 | H89 | S87-H89 PolarHBondContact O-N 3.26Å; S87-H89 VanDerWaalsContact O-N 3.17Å | ||
| 88 | W | 33 | Very low | 33.3 | Very low | 243 Ų | 243 | 152.7 Ų | 152.7 | 92% | 0.92 | 83% | 0.828 | S | S | * | * | trans | -74.4 | 97.5 | 167.7 | -82.9 | 54.8 | 0 | 0 | 0 | 108.2 | L86 N90 | L86-W88 PolarHBondContact O-N 2.96Å; W88-N90 PolarHBondContact O-N 3.38Å | ||
| 89 | H | 33.7 | Very low | 33.2 | Very low | 172 Ų | 172 | 148.1 Ų | 148.1 | 80% | 0.796 | 82% | 0.823 | S | S | * | * | trans | -71.2 | 113.5 | 163.4 | -105.4 | -84.7 | 0 | 0 | 0 | 108.7 | S87 C91 | S87-H89 PolarHBondContact O-N 3.26Å; S87-H89 VanDerWaalsContact O-N 3.17Å; H89-C91 PolarHBondContact O-N 3.15Å; H89-C91 VanDerWaalsContact O-N 3.15Å | ||
| 90 | N | 34.5 | Very low | 33.4 | Very low | 156 Ų | 156 | 147.2 Ų | 147.2 | 83% | 0.834 | 83% | 0.828 | S | S | * | * | trans | -49.3 | 111.6 | 170.1 | -78.2 | -31 | 0 | 0 | 0 | 111 | W88 S92 | W88-N90 PolarHBondContact O-N 3.38Å; N90-S92 PolarHBondContact O-N 3.18Å | ||
| 91 | C | 29.8 | Very low | 33.3 | Very low | 117 Ų | 117 | 150.1 Ų | 150.1 | 79% | 0.791 | 83% | 0.827 | S | S | * | * | trans | -91.3 | 94.7 | 168 | -148 | 0 | 0 | 0 | 0 | 107.8 | H89 C93 | H89-C91 PolarHBondContact O-N 3.15Å; H89-C91 VanDerWaalsContact O-N 3.15Å; C91-C93 PolarHBondContact O-N 2.84Å | ||
| 92 | S | 31.1 | Very low | 33.5 | Very low | 110 Ų | 110 | 148.6 Ų | 148.6 | 77% | 0.769 | 83% | 0.827 | S | S | * | * | trans | -77.5 | 100.8 | 172.5 | -174.9 | 0 | 0 | 0 | 0 | 108.7 | N90 | N90-S92 PolarHBondContact O-N 3.18Š| ||
| 93 | C | 31 | Very low | 33.9 | Very low | 110 Ų | 110 | 149.7 Ų | 149.7 | 74% | 0.743 | 83% | 0.829 | S | S | * | * | trans | -132.2 | 58.4 | 170.2 | -63.1 | 0 | 0 | 0 | 0 | 109.5 | C91 | C91-C93 PolarHBondContact O-N 2.84Š| ||
| 94 | D | 30.1 | Very low | 34.2 | Very low | 146 Ų | 146 | 147.8 Ų | 147.8 | 78% | 0.781 | 82% | 0.824 | S | S | * | * | trans | -125.5 | 102 | 164.8 | -91.6 | -60.7 | 0 | 0 | 0 | 106.5 | ||||
| 95 | D | 31.9 | Very low | 34.6 | Very low | 166 Ų | 166 | 150 Ų | 150 | 89% | 0.888 | 83% | 0.828 | S | S | * | * | trans | 157 | 80.7 | 153.6 | -89.1 | -32.4 | 0 | 0 | 0 | 109.5 | ||||
| 96 | E | 34.1 | Very low | 34.9 | Very low | 192 Ų | 192 | 148.6 Ų | 148.6 | 90% | 0.897 | 82% | 0.822 | S | S | * | * | trans | -172.8 | 64.5 | 148 | -109.6 | -172.9 | 177 | 0 | 0 | 111.9 | ||||
| 97 | L | 35.4 | Very low | 35.2 | Very low | 182 Ų | 182 | 146 Ų | 146 | 95% | 0.953 | 82% | 0.823 | S | S | * | * | trans | -133.8 | 62.2 | 161.3 | -82.1 | 170.2 | 0 | 0 | 0 | 110 | ||||
| 98 | R | 35.9 | Very low | 35.3 | Very low | 248 Ų | 248 | 150.1 Ų | 150.1 | 94% | 0.936 | 83% | 0.831 | S | S | * | * | trans | -84.7 | 113.5 | 161.9 | -87.2 | -174.3 | 175.3 | -140.3 | 0.3 | 109.8 | ||||
| 99 | S | 34.8 | Very low | 35.5 | Very low | 116 Ų | 116 | 147.6 Ų | 147.6 | 81% | 0.811 | 83% | 0.829 | S | S | * | * | trans | 56.8 | 78.8 | 135.5 | 176.9 | 0 | 0 | 0 | 0 | 117 | ||||
| 100 | S | 37.6 | Very low | 35.7 | Very low | 121 Ų | 121 | 146 Ų | 146 | 85% | 0.846 | 83% | 0.832 | S | S | * | * | trans | -109.5 | 115.9 | 147.8 | 46.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 101 | K | 38 | Very low | 35.9 | Very low | 189 Ų | 189 | 145.1 Ų | 145.1 | 82% | 0.822 | 83% | 0.831 | S | S | * | * | trans | -57.2 | 141.2 | -179.2 | -132.4 | 168.5 | -178.3 | 177.1 | 0 | 110.5 | T103 | K101-T103 PolarHBondContact O-N 3.22Š| ||
| 102 | P | 40 | Very low | 36.4 | Very low | 128 Ų | 128 | 144.8 Ų | 144.8 | 83% | 0.831 | 83% | 0.83 | S | S | * | * | trans | -73.6 | 111.4 | -176.7 | 28.1 | -31.8 | 0 | 0 | 0 | 110.8 | ||||
| 103 | T | 40.6 | Very low | 37 | Very low | 127 Ų | 127 | 144 Ų | 144 | 78% | 0.779 | 83% | 0.831 | S | S | * | * | trans | -78.7 | 124.1 | 165.8 | -50.4 | 0 | 0 | 0 | 0 | 108.5 | K101 V105 | K101-T103 PolarHBondContact O-N 3.22Å; T103-V105 PolarHBondContact O-N 3.34Å | ||
| 104 | A | 33.8 | Very low | 37.8 | Very low | 100 Ų | 100 | 148.1 Ų | 148.1 | 83% | 0.826 | 84% | 0.836 | S | S | * | * | trans | -57.8 | 124 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 105 | V | 41.7 | Very low | 38.5 | Very low | 128 Ų | 128 | 153 Ų | 153 | 78% | 0.776 | 84% | 0.843 | S | S | * | * | trans | -124.3 | 132.7 | 169.7 | -177.8 | 0 | 0 | 0 | 0 | 107.2 | T103 | T103-V105 PolarHBondContact O-N 3.34Š| ||
| 106 | P | 40.3 | Very low | 39.6 | Very low | 119 Ų | 119 | 151.3 Ų | 151.3 | 77% | 0.773 | 83% | 0.833 | S | S | * | * | trans | -76.3 | 152.4 | -163.1 | 29.2 | -34 | 0 | 0 | 0 | 113.3 | E108 | P106-E108 PolarHBondContact O-N 3.38Š| ||
| 107 | A | 38.6 | Very low | 41.5 | Very low | 97 Ų | 97 | 146.4 Ų | 146.4 | 80% | 0.802 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -55.1 | 126 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 108 | E | 36 | Very low | 43.4 | Very low | 186 Ų | 186 | 145.8 Ų | 145.8 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | trans | 155.7 | 71.6 | 147 | -88.1 | -170.1 | 165.1 | 0 | 0 | 109.9 | P106 | P106-E108 PolarHBondContact O-N 3.38Š| ||
| 109 | Q | 36.9 | Very low | 44.8 | Very low | 190 Ų | 190 | 142.1 Ų | 142.1 | 89% | 0.888 | 79% | 0.785 | S | S | * | * | trans | -138.7 | 87.7 | 151.9 | -71.3 | -166.9 | 22.3 | 0 | 0 | 108.1 | V111 | Q109-V111 PolarHBondContact O-N 3.45Š| ||
| 110 | T | 37.4 | Very low | 46.7 | Very low | 139 Ų | 139 | 138.8 Ų | 138.8 | 85% | 0.853 | 76% | 0.761 | S | S | * | * | trans | -59.4 | 100.5 | 163.9 | 34.8 | 0 | 0 | 0 | 0 | 108.3 | S112 | T110-S112 VanDerWaalsContact C-N 3.3Å; T110-S112 PolarHBondContact O-N 3.05Å | ||
| 111 | V | 39.4 | Very low | 48.5 | Very low | 136 Ų | 136 | 136 Ų | 136 | 82% | 0.824 | 74% | 0.739 | S | S | * | * | trans | -63.2 | 95.6 | 169.9 | 179.4 | 0 | 0 | 0 | 0 | 107.2 | Q109 A113 | Q109-V111 PolarHBondContact O-N 3.45Å; V111-A113 PolarHBondContact O-N 2.94Å | ||
| 112 | S | 40.4 | Very low | 50.2 | Low | 110 Ų | 110 | 131.2 Ų | 131.2 | 77% | 0.769 | 73% | 0.725 | S | S | * | * | trans | -56.4 | 106.3 | 169.7 | -95.1 | 0 | 0 | 0 | 0 | 108.5 | T110 K114 | T110-S112 VanDerWaalsContact C-N 3.3Å; T110-S112 PolarHBondContact O-N 3.05Å; S112-K114 PolarHBondContact O-N 3.14Å | ||
| 113 | A | 42.6 | Very low | 51.9 | Low | 95 Ų | 95 | 127.8 Ų | 127.8 | 79% | 0.785 | 71% | 0.708 | S | S | * | * | trans | -57.9 | 100.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | V111 R115 | V111-A113 PolarHBondContact O-N 2.94Å; A113-R115 PolarHBondContact O-N 3.4Å | ||
| 114 | K | 49.1 | Very low | 53.6 | Low | 195 Ų | 195 | 129.6 Ų | 129.6 | 85% | 0.848 | 70% | 0.7 | S | S | * | * | trans | -63 | 102.8 | 176.9 | -134.4 | 170.7 | -172.9 | 172.2 | 0 | 107 | S112 I116 | S112-K114 PolarHBondContact O-N 3.14Å; K114-I116 PolarHBondContact O-N 2.99Å | ||
| 115 | R | 43.3 | Very low | 55.8 | Low | 248 Ų | 248 | 128.7 Ų | 128.7 | 94% | 0.936 | 68% | 0.684 | S | S | * | * | trans | -61.8 | 98.8 | 176.9 | -158.9 | -178.7 | -161.3 | -156.2 | 5.7 | 107.8 | A113 D117 | A113-R115 PolarHBondContact O-N 3.4Å; R115-D117 PolarHBondContact O-N 3.11Å; R115-D117 VanDerWaalsContact O-N 3.16Å | ||
| 116 | I | 55.9 | Low | 57.5 | Low | 131 Ų | 131 | 125.3 Ų | 125.3 | 67% | 0.672 | 67% | 0.67 | S | S | * | * | trans | -70.3 | 110.3 | 174.8 | -62.4 | 172.5 | 0 | 0 | 0 | 106.5 | K114 W118 | K114-I116 PolarHBondContact O-N 2.99Å; I116-W118 PolarHBondContact O-N 3.15Å; I116-W118 VanDerWaalsContact O-N 3.12Å | ||
| 117 | D | 74.3 | Confident | 59.4 | Low | 89 Ų | 89 | 123.2 Ų | 123.2 | 48% | 0.476 | 66% | 0.655 | S | S | . | * | trans | -66.5 | 108.1 | 172 | 179.5 | 10.1 | 0 | 0 | 0 | 109.2 | R115 R119 S120 T121 | R115-D117 PolarHBondContact O-N 3.11Å; R115-D117 VanDerWaalsContact O-N 3.16Å; D117-R119 PolarHBondContact O-N 3.12Å; D117-R119 VanDerWaalsContact O-N 3.15Å; D117-R119 WeakPolarHBondContact OD1-CB 3.5Å; D117-R119 PolarHBondContact OD1-N 3.16Å; D117-R119 VanDerWaalsContact OD1-N 3.11Å; D117-S120 VanDerWaalsContact O-CB 3.31Å; D117-S120 WeakPolarHBondContact O-CB 3.3Å; D117-S120 PolarHBondContact O-N 3.27Å; D117-T121 PolarHBondContact O-N 2.91Å | ||
| 118 | W | 75.2 | Confident | 61.3 | Low | 170 Ų | 170 | 121 Ų | 121 | 64% | 0.644 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -57.9 | -27.4 | -178.7 | 63.6 | -92.9 | 0 | 0 | 0 | 112.4 | I116 S120 T121 V122 | I116-W118 PolarHBondContact O-N 3.15Å; I116-W118 VanDerWaalsContact O-N 3.12Å; W118-S120 VanDerWaalsContact C-N 3.28Å; W118-S120 PolarHBondContact O-N 3.44Å; W118-T121 PolarHBondContact O-N 3.27Å; W118-T121 VanDerWaalsContact O-N 3.14Å; W118-V122 HydrophobicContact CE3-CG2 4.1Å; W118-V122 WeakPolarHBondContact O-CG2 3.34Å; W118-V122 PolarHBondContact O-N 2.93Å |
| 119 | R | 65.7 | Low | 63.2 | Low | 171 Ų | 171 | 117.1 Ų | 117.1 | 65% | 0.645 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -62.9 | -37.5 | 175.9 | -65.4 | -176.5 | 171 | -168.2 | -1.9 | 111.4 | D117 A123 | D117-R119 PolarHBondContact O-N 3.12Å; D117-R119 VanDerWaalsContact O-N 3.15Å; D117-R119 WeakPolarHBondContact OD1-CB 3.5Å; D117-R119 PolarHBondContact OD1-N 3.16Å; D117-R119 VanDerWaalsContact OD1-N 3.11Å; R119-A123 WeakPolarHBondContact O-CB 3.42Å; R119-A123 PolarHBondContact O-N 3.03Å |
| 120 | S | 73.4 | Confident | 65 | Low | 46 Ų | 46 | 110.1 Ų | 110.1 | 32% | 0.322 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -67.9 | -35 | 175.3 | -173.4 | 0 | 0 | 0 | 0 | 112.3 | D117 W118 R124 | D117-S120 VanDerWaalsContact O-CB 3.31Å; D117-S120 WeakPolarHBondContact O-CB 3.3Å; D117-S120 PolarHBondContact O-N 3.27Å; W118-S120 VanDerWaalsContact C-N 3.28Å; W118-S120 PolarHBondContact O-N 3.44Å; S120-R124 WeakPolarHBondContact O-CB 3.5Å; S120-R124 VanDerWaalsContact O-CG 3.31Å; S120-R124 WeakPolarHBondContact O-CG 3.48Å; S120-R124 PolarHBondContact O-N 2.85Å; S120-R124 VanDerWaalsContact O-N 3.15Å; S120-R124 PolarHBondContact O-NE 3.33Å; S120-R124 PolarHBondContact OG-NE 3.48Å; S120-R124 PolarHBondContact OG-NH2 2.68Å |
| 121 | T | 76.1 | Confident | 66.9 | Low | 61 Ų | 61 | 111.7 Ų | 111.7 | 37% | 0.374 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -70.9 | -46 | 177.3 | -53.9 | 0 | 0 | 0 | 0 | 111 | D117 W118 A123 R124 V125 | D117-T121 PolarHBondContact O-N 2.91Å; W118-T121 PolarHBondContact O-N 3.27Å; W118-T121 VanDerWaalsContact O-N 3.14Å; T121-A123 PolarHBondContact O-N 2.87Å; T121-R124 PolarHBondContact O-N 3.32Å; T121-V125 WeakPolarHBondContact O-CG2 3.43Å; T121-V125 PolarHBondContact O-N 3Å |
| 122 | V | 73.2 | Confident | 68.7 | Low | 89 Ų | 89 | 111.6 Ų | 111.6 | 54% | 0.539 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -60.5 | -44.9 | 177.2 | 173.6 | 0 | 0 | 0 | 0 | 111 | W118 R124 V125 A126 | W118-V122 HydrophobicContact CE3-CG2 4.1Å; W118-V122 WeakPolarHBondContact O-CG2 3.34Å; W118-V122 PolarHBondContact O-N 2.93Å; V122-R124 VanDerWaalsContact C-N 3.31Å; V122-R124 PolarHBondContact O-N 3.45Å; V122-V125 PolarHBondContact O-N 3.22Å; V122-A126 WeakPolarHBondContact O-CB 3.39Å; V122-A126 PolarHBondContact O-N 3.43Å |
| 123 | A | 75.2 | Confident | 70.1 | Confident | 56 Ų | 56 | 111.8 Ų | 111.8 | 46% | 0.463 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -60.1 | -40.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | R119 T121 V127 | R119-A123 WeakPolarHBondContact O-CB 3.42Å; R119-A123 PolarHBondContact O-N 3.03Å; T121-A123 PolarHBondContact O-N 2.87Å; A123-V127 VanDerWaalsContact O-CG2 3.3Å; A123-V127 WeakPolarHBondContact O-CG2 3.31Å; A123-V127 PolarHBondContact O-N 3.15Å; A123-V127 VanDerWaalsContact O-N 3.09Å |
| 124 | R | 78.3 | Confident | 71.4 | Confident | 166 Ų | 166 | 112.9 Ų | 112.9 | 63% | 0.626 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.6 | -40.7 | 177.1 | -78.7 | -176.9 | -101.9 | -173.7 | -7.2 | 112.7 | S120 T121 V122 V127 A128 | S120-R124 WeakPolarHBondContact O-CB 3.5Å; S120-R124 VanDerWaalsContact O-CG 3.31Å; S120-R124 WeakPolarHBondContact O-CG 3.48Å; S120-R124 PolarHBondContact O-N 2.85Å; S120-R124 VanDerWaalsContact O-N 3.15Å; S120-R124 PolarHBondContact O-NE 3.33Å; S120-R124 PolarHBondContact OG-NE 3.48Å; S120-R124 PolarHBondContact OG-NH2 2.68Å; T121-R124 PolarHBondContact O-N 3.32Å; V122-R124 VanDerWaalsContact C-N 3.31Å; V122-R124 PolarHBondContact O-N 3.45Å; R124-V127 PolarHBondContact O-N 3.26Å; R124-A128 WeakPolarHBondContact O-CB 3.47Å; R124-A128 PolarHBondContact O-N 3.32Å |
| 125 | V | 79.9 | Confident | 72.7 | Confident | 80 Ų | 80 | 114 Ų | 114 | 49% | 0.485 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.9 | -43.7 | 177.1 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | T121 V122 V127 A128 L129 | T121-V125 WeakPolarHBondContact O-CG2 3.43Å; T121-V125 PolarHBondContact O-N 3Å; V122-V125 PolarHBondContact O-N 3.22Å; V125-V127 PolarHBondContact O-N 2.91Å; V125-A128 PolarHBondContact O-N 2.95Å; V125-L129 HydrophobicContact CG1-CD1 4.12Å; V125-L129 WeakPolarHBondContact O-CB 3.38Å; V125-L129 PolarHBondContact O-N 3.39Å |
| 126 | A | 75.5 | Confident | 74 | Confident | 57 Ų | 57 | 106.9 Ų | 106.9 | 47% | 0.471 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61 | -43.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V122 A128 L129 A130 | V122-A126 WeakPolarHBondContact O-CB 3.39Å; V122-A126 PolarHBondContact O-N 3.43Å; A126-A128 PolarHBondContact O-N 3.26Å; A126-L129 PolarHBondContact O-N 2.82Å; A126-A130 WeakPolarHBondContact O-CB 3.39Å; A126-A130 PolarHBondContact O-N 2.99Å |
| 127 | V | 80.9 | Confident | 74 | Confident | 76 Ų | 76 | 104.6 Ų | 104.6 | 46% | 0.461 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.5 | -38 | 176.3 | 171.7 | 0 | 0 | 0 | 0 | 111.7 | A123 R124 V125 R131 | A123-V127 VanDerWaalsContact O-CG2 3.3Å; A123-V127 WeakPolarHBondContact O-CG2 3.31Å; A123-V127 PolarHBondContact O-N 3.15Å; A123-V127 VanDerWaalsContact O-N 3.09Å; R124-V127 PolarHBondContact O-N 3.26Å; V125-V127 PolarHBondContact O-N 2.91Å; V127-R131 WeakPolarHBondContact O-CB 3.43Å; V127-R131 WeakPolarHBondContact O-CG 3.31Å; V127-R131 PolarHBondContact O-N 3.36Å; V127-R131 VanDerWaalsContact O-N 3.08Å |
| 128 | A | 78.8 | Confident | 72.9 | Confident | 51 Ų | 51 | 106.1 Ų | 106.1 | 42% | 0.421 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -65.8 | -45.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | R124 V125 A126 R131 Q132 | R124-A128 WeakPolarHBondContact O-CB 3.47Å; R124-A128 PolarHBondContact O-N 3.32Å; V125-A128 PolarHBondContact O-N 2.95Å; A126-A128 PolarHBondContact O-N 3.26Å; A128-R131 PolarHBondContact O-N 2.88Å; A128-Q132 PolarHBondContact O-N 2.99Å |
| 129 | L | 76.8 | Confident | 71.7 | Confident | 103 Ų | 103 | 100.3 Ų | 100.3 | 54% | 0.539 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.1 | -46.1 | 176.1 | -106.4 | 150.7 | 0 | 0 | 0 | 112.1 | V125 A126 R131 Q132 L133 | V125-L129 HydrophobicContact CG1-CD1 4.12Å; V125-L129 WeakPolarHBondContact O-CB 3.38Å; V125-L129 PolarHBondContact O-N 3.39Å; A126-L129 PolarHBondContact O-N 2.82Å; L129-R131 VanDerWaalsContact C-N 3.31Å; L129-R131 PolarHBondContact O-N 3Å; L129-Q132 PolarHBondContact O-N 3.36Å; L129-Q132 VanDerWaalsContact O-N 3.1Å; L129-L133 WeakPolarHBondContact O-CG 3.28Å; L129-L133 PolarHBondContact O-N 2.87Å |
| 130 | A | 73.7 | Confident | 70.7 | Confident | 44 Ų | 44 | 99 Ų | 99 | 36% | 0.364 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.1 | -41.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | A126 Q132 L134 | A126-A130 WeakPolarHBondContact O-CB 3.39Å; A126-A130 PolarHBondContact O-N 2.99Å; A130-Q132 VanDerWaalsContact C-N 3.32Å; A130-Q132 PolarHBondContact O-N 3.1Å; A130-L134 VanDerWaalsContact O-CG 3.3Å; A130-L134 WeakPolarHBondContact O-CG 3.49Å; A130-L134 PolarHBondContact O-N 3.17Å |
| 131 | R | 76.9 | Confident | 69.3 | Low | 171 Ų | 171 | 101.4 Ų | 101.4 | 65% | 0.645 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.5 | -34.7 | 174.7 | -76.7 | 176.6 | 177.3 | 170.6 | 0.4 | 112.8 | V127 A128 L129 R135 | V127-R131 WeakPolarHBondContact O-CB 3.43Å; V127-R131 WeakPolarHBondContact O-CG 3.31Å; V127-R131 PolarHBondContact O-N 3.36Å; V127-R131 VanDerWaalsContact O-N 3.08Å; A128-R131 PolarHBondContact O-N 2.88Å; L129-R131 VanDerWaalsContact C-N 3.31Å; L129-R131 PolarHBondContact O-N 3Å; R131-R135 WeakPolarHBondContact O-CG 3.3Å; R131-R135 PolarHBondContact O-N 2.96Å |
| 132 | Q | 76.7 | Confident | 67.5 | Low | 135 Ų | 135 | 104.4 Ų | 104.4 | 63% | 0.631 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72.2 | -41.5 | 179.3 | -163.8 | 143.9 | -14 | 0 | 0 | 111.5 | A128 L129 A130 L134 R135 T136 | A128-Q132 PolarHBondContact O-N 2.99Å; L129-Q132 PolarHBondContact O-N 3.36Å; L129-Q132 VanDerWaalsContact O-N 3.1Å; A130-Q132 VanDerWaalsContact C-N 3.32Å; A130-Q132 PolarHBondContact O-N 3.1Å; Q132-L134 VanDerWaalsContact C-N 3.32Å; Q132-L134 PolarHBondContact O-N 3.35Å; Q132-R135 PolarHBondContact O-N 3.27Å; Q132-R135 VanDerWaalsContact O-N 3.12Å; Q132-T136 PolarHBondContact O-N 3Å; Q132-T136 PolarHBondContact O-OG1 3.15Å |
| 133 | L | 71.2 | Confident | 66.1 | Low | 113 Ų | 113 | 106.9 Ų | 106.9 | 59% | 0.592 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -62.3 | -38.3 | 173.5 | -69.2 | 172.5 | 0 | 0 | 0 | 112.3 | L129 R135 T136 S137 | L129-L133 WeakPolarHBondContact O-CG 3.28Å; L129-L133 PolarHBondContact O-N 2.87Å; L133-R135 VanDerWaalsContact C-N 3.26Å; L133-R135 PolarHBondContact O-N 3.17Å; L133-T136 PolarHBondContact O-N 3.32Å; L133-T136 PolarHBondContact O-OG1 3.44Å; L133-S137 PolarHBondContact O-N 3.35Å |
| 134 | L | 70.4 | Confident | 64.4 | Low | 118 Ų | 118 | 109.3 Ų | 109.3 | 62% | 0.618 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -67.5 | -24.1 | 175.1 | -74.5 | 167.7 | 0 | 0 | 0 | 113.4 | A130 Q132 | A130-L134 VanDerWaalsContact O-CG 3.3Å; A130-L134 WeakPolarHBondContact O-CG 3.49Å; A130-L134 PolarHBondContact O-N 3.17Å; Q132-L134 VanDerWaalsContact C-N 3.32Å; Q132-L134 PolarHBondContact O-N 3.35Å |
| 135 | R | 75 | Confident | 62.7 | Low | 220 Ų | 220 | 107.2 Ų | 107.2 | 83% | 0.83 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -81.9 | -26.6 | 175.9 | -75.8 | 179.5 | -179.2 | -178.4 | -0.5 | 112.9 | R131 Q132 L133 | R131-R135 WeakPolarHBondContact O-CG 3.3Å; R131-R135 PolarHBondContact O-N 2.96Å; Q132-R135 PolarHBondContact O-N 3.27Å; Q132-R135 VanDerWaalsContact O-N 3.12Å; L133-R135 VanDerWaalsContact C-N 3.26Å; L133-R135 PolarHBondContact O-N 3.17Å |
| 136 | T | 70.8 | Confident | 61.2 | Low | 98 Ų | 98 | 107.9 Ų | 107.9 | 60% | 0.601 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -89.9 | -14.2 | -177.8 | 55.8 | 0 | 0 | 0 | 0 | 113.3 | Q132 L133 S138 | Q132-T136 PolarHBondContact O-N 3Å; Q132-T136 PolarHBondContact O-OG1 3.15Å; L133-T136 PolarHBondContact O-N 3.32Å; L133-T136 PolarHBondContact O-OG1 3.44Å; T136-S138 PolarHBondContact O-N 3.43Å |
| 137 | S | 55.2 | Low | 59.8 | Low | 82 Ų | 82 | 108.4 Ų | 108.4 | 57% | 0.573 | 65% | 0.648 | S | S | * | * | trans | -77.1 | 71.8 | 174.1 | 72.9 | 0 | 0 | 0 | 0 | 111.6 | L133 G139 | L133-S137 PolarHBondContact O-N 3.35Å; S137-G139 VanDerWaalsContact C-N 3.3Å; S137-G139 PolarHBondContact O-N 3.14Å | ||
| 138 | S | 52 | Low | 58.1 | Low | 122 Ų | 122 | 108.6 Ų | 108.6 | 85% | 0.853 | 66% | 0.657 | S | S | * | * | trans | -87 | 72.2 | 164 | 56.4 | 0 | 0 | 0 | 0 | 109.2 | T136 | T136-S138 PolarHBondContact O-N 3.43Š| ||
| 139 | G | 49.1 | Very low | 56.7 | Low | 47 Ų | 47 | 109.8 Ų | 109.8 | 49% | 0.485 | 66% | 0.659 | S | S | . | * | trans | -156 | 116.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | S137 S141 | S137-G139 VanDerWaalsContact C-N 3.3Å; S137-G139 PolarHBondContact O-N 3.14Å; G139-S141 PolarHBondContact O-N 2.75Å | ||
| 140 | P | 45.9 | Very low | 55.2 | Low | 144 Ų | 144 | 115 Ų | 115 | 94% | 0.935 | 67% | 0.673 | S | S | * | * | trans | -79.6 | 77.7 | 178.1 | 32.9 | -31.8 | 0 | 0 | 0 | 109.1 | ||||
| 141 | S | 44.5 | Very low | 53.6 | Low | 96 Ų | 96 | 118.4 Ų | 118.4 | 67% | 0.671 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -153 | 108.6 | 165 | 53.6 | 0 | 0 | 0 | 0 | 108.8 | G139 V143 | G139-S141 PolarHBondContact O-N 2.75Å; S141-V143 PolarHBondContact O-N 2.92Å |
| 142 | C | 36.9 | Very low | 52 | Low | 124 Ų | 124 | 114.8 Ų | 114.8 | 84% | 0.838 | 69% | 0.694 | S | S | * | * | trans | 9.6 | 86.5 | 166.7 | -70.2 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 143 | V | 44.2 | Very low | 50.5 | Low | 141 Ų | 141 | 115.1 Ų | 115.1 | 86% | 0.855 | 70% | 0.699 | S | S | * | * | trans | -122.3 | 56.7 | 146.2 | -165.3 | 0 | 0 | 0 | 0 | 107.6 | S141 | S141-V143 PolarHBondContact O-N 2.92Š| ||
| 144 | C | 38.7 | Very low | 49.3 | Very low | 107 Ų | 107 | 118.8 Ų | 118.8 | 72% | 0.723 | 71% | 0.713 | S | S | * | * | trans | -86.8 | 137.1 | 165.5 | -53.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 145 | V | 44.4 | Very low | 48 | Very low | 123 Ų | 123 | 124.1 Ų | 124.1 | 75% | 0.745 | 73% | 0.725 | S | S | * | * | S | Bend | trans | 80.4 | 90.3 | 179.5 | -159.7 | 0 | 0 | 0 | 0 | 112.4 | ||
| 146 | S | 48.2 | Very low | 46.4 | Very low | 94 Ų | 94 | 122.8 Ų | 122.8 | 66% | 0.657 | 73% | 0.726 | S | S | * | * | S | Bend | -161.4 | 7.2 | 92.7 | -173.5 | 0 | 0 | 0 | 0 | 115.3 | |||
| 147 | A | 44.6 | Very low | 44.9 | Very low | 68 Ų | 68 | 123 Ų | 123 | 56% | 0.562 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -85.7 | -30 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 148 | A | 46 | Very low | 44.2 | Very low | 80 Ų | 80 | 122.7 Ų | 122.7 | 66% | 0.661 | 74% | 0.74 | S | S | * | * | H | α-helix | trans | -75.8 | -26.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y150 S152 | A148-Y150 VanDerWaalsContact C-N 3.3Å; A148-Y150 PolarHBondContact O-N 3.34Å; A148-S152 PolarHBondContact O-N 3.25Å |
| 149 | T | 49.7 | Very low | 43.8 | Very low | 76 Ų | 76 | 122.4 Ų | 122.4 | 47% | 0.466 | 74% | 0.738 | S | S | . | * | H | α-helix | trans | -72.4 | -24.1 | -179.5 | -24.5 | 0 | 0 | 0 | 0 | 112.5 | ||
| 150 | Y | 45.4 | Very low | 43.5 | Very low | 211 Ų | 211 | 126 Ų | 126 | 83% | 0.827 | 75% | 0.745 | S | S | * | * | H | α-helix | trans | -80.6 | -28.9 | 179 | -147 | -90.6 | 0 | 0 | 0 | 113.1 | A148 | A148-Y150 VanDerWaalsContact C-N 3.3Å; A148-Y150 PolarHBondContact O-N 3.34Å |
| 151 | C | 40.4 | Very low | 43.4 | Very low | 116 Ų | 116 | 127 Ų | 127 | 78% | 0.784 | 74% | 0.742 | S | S | * | * | H | α-helix | trans | -94.3 | -11.6 | -177.9 | -84.1 | 0 | 0 | 0 | 0 | 115.3 | ||
| 152 | S | 42.3 | Very low | 43.4 | Very low | 95 Ų | 95 | 128.8 Ų | 128.8 | 66% | 0.664 | 74% | 0.743 | S | S | * | * | H | α-helix | trans | -98.4 | -10.3 | 178.3 | -120 | 0 | 0 | 0 | 0 | 114.7 | A148 E154 | A148-S152 PolarHBondContact O-N 3.25Å; S152-E154 PolarHBondContact O-N 2.94Å |
| 153 | L | 44.6 | Very low | 43.8 | Very low | 142 Ų | 142 | 128.8 Ų | 128.8 | 74% | 0.743 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.8 | -16 | -177.4 | -123.3 | 96.8 | 0 | 0 | 0 | 114.4 | R155 | L153-R155 PolarHBondContact O-N 3.43Š|
| 154 | E | 46.4 | Very low | 43.8 | Very low | 190 Ų | 190 | 126.1 Ų | 126.1 | 89% | 0.888 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.4 | -6.4 | -177.6 | -85.1 | -160.5 | 161.2 | 0 | 0 | 115.2 | S152 | S152-E154 PolarHBondContact O-N 2.94Š|
| 155 | R | 44.2 | Very low | 44.4 | Very low | 230 Ų | 230 | 131.8 Ų | 131.8 | 87% | 0.868 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -122.3 | -5.9 | -171.4 | -83.6 | -166.4 | -170 | 180 | 4.7 | 119.8 | L153 | L153-R155 PolarHBondContact O-N 3.43Š|
| 156 | K | 41.5 | Very low | 44.6 | Very low | 192 Ų | 192 | 128.5 Ų | 128.5 | 84% | 0.835 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -175 | 102.6 | 171 | -102.1 | 142.9 | -175.7 | -167 | 0 | 109.2 | ||
| 157 | C | 37.9 | Very low | 44.8 | Very low | 103 Ų | 103 | 127.9 Ų | 127.9 | 70% | 0.696 | 72% | 0.715 | S | S | * | * | trans | -174.7 | 87.1 | 142.1 | -100.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 158 | G | 40.4 | Very low | 45.2 | Very low | 75 Ų | 75 | 128.7 Ų | 128.7 | 77% | 0.773 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -58 | 134.6 | 148.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | L160 | G158-L160 PolarHBondContact O-N 2.74Š|
| 159 | S | 43.9 | Very low | 45.4 | Very low | 117 Ų | 117 | 130.7 Ų | 130.7 | 82% | 0.818 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 55.8 | 52.1 | 158.8 | -164.1 | 0 | 0 | 0 | 0 | 117.7 | ||
| 160 | L | 43.2 | Very low | 45.7 | Very low | 123 Ų | 123 | 132.7 Ų | 132.7 | 64% | 0.644 | 72% | 0.723 | S | S | * | * | trans | -121.2 | 86.1 | 156 | -102.7 | 150.1 | 0 | 0 | 0 | 108.5 | G158 L162 | G158-L160 PolarHBondContact O-N 2.74Å; L160-L162 HydrophobicContact CB-CD1 4.37Å; L160-L162 HydrophobicContact CD2-CD1 3.81Å; L160-L162 PolarHBondContact O-N 3.1Å | ||
| 161 | L | 43.3 | Very low | 46 | Very low | 164 Ų | 164 | 127.7 Ų | 127.7 | 86% | 0.859 | 71% | 0.714 | S | S | * | * | trans | -63.7 | 68.8 | 164.5 | -81.7 | 155.7 | 0 | 0 | 0 | 109.1 | T163 | L161-T163 PolarHBondContact O-N 2.76Å; L161-T163 VanDerWaalsContact O-N 3.13Å | ||
| 162 | L | 44.8 | Very low | 46.5 | Very low | 133 Ų | 133 | 125.4 Ų | 125.4 | 70% | 0.696 | 70% | 0.704 | S | S | * | * | trans | -69.9 | 106.9 | 158.3 | -94.1 | 107.1 | 0 | 0 | 0 | 106.7 | L160 C164 | L160-L162 HydrophobicContact CB-CD1 4.37Å; L160-L162 HydrophobicContact CD2-CD1 3.81Å; L160-L162 PolarHBondContact O-N 3.1Å; L162-C164 VanDerWaalsContact C-N 3.29Å; L162-C164 PolarHBondContact O-N 3.12Å | ||
| 163 | T | 46.3 | Very low | 47 | Very low | 124 Ų | 124 | 126.1 Ų | 126.1 | 76% | 0.761 | 70% | 0.704 | S | S | * | * | trans | -59.1 | 89.7 | 171.8 | 49.2 | 0 | 0 | 0 | 0 | 109.5 | L161 R165 | L161-T163 PolarHBondContact O-N 2.76Å; L161-T163 VanDerWaalsContact O-N 3.13Å; T163-R165 PolarHBondContact O-N 2.9Å | ||
| 164 | C | 44.5 | Very low | 47.3 | Very low | 85 Ų | 85 | 123.9 Ų | 123.9 | 57% | 0.574 | 70% | 0.699 | S | S | * | * | trans | -69.8 | 58.6 | 170.4 | -73.1 | 0 | 0 | 0 | 0 | 111.1 | L162 G166 V167 | L162-C164 VanDerWaalsContact C-N 3.29Å; L162-C164 PolarHBondContact O-N 3.12Å; C164-G166 PolarHBondContact O-N 3.34Å; C164-V167 HydrophobicContact CB-CB 4.44Å; C164-V167 HydrophobicContact CB-CG2 3.92Å | ||
| 165 | R | 50 | Low | 47.7 | Very low | 227 Ų | 227 | 118.1 Ų | 118.1 | 86% | 0.857 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | -14.5 | 174.1 | -114.7 | 179.9 | 172.7 | 178.8 | -2.5 | 112.8 | T163 | T163-R165 PolarHBondContact O-N 2.9Š|
| 166 | G | 48.2 | Very low | 48.2 | Very low | 54 Ų | 54 | 111.4 Ų | 111.4 | 56% | 0.557 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | -19.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | C164 | C164-G166 PolarHBondContact O-N 3.34Š|
| 167 | V | 53.9 | Low | 49 | Very low | 81 Ų | 81 | 104.6 Ų | 104.6 | 49% | 0.491 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -83.8 | -28.3 | -173.9 | -169.2 | 0 | 0 | 0 | 0 | 111.7 | C164 N169 I170 V171 | C164-V167 HydrophobicContact CB-CB 4.44Å; C164-V167 HydrophobicContact CB-CG2 3.92Å; V167-N169 VanDerWaalsContact C-N 3.27Å; V167-N169 PolarHBondContact O-N 2.9Å; V167-I170 PolarHBondContact O-N 3.21Å; V167-V171 PolarHBondContact O-N 3.28Å |
| 168 | S | 52.9 | Low | 50.3 | Low | 85 Ų | 85 | 104.9 Ų | 104.9 | 59% | 0.594 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -62.6 | -31.4 | 178.3 | -56.1 | 0 | 0 | 0 | 0 | 113.2 | A172 | S168-A172 PolarHBondContact O-N 3.42Å |
| 169 | N | 49.9 | Very low | 51.7 | Low | 122 Ų | 122 | 107.7 Ų | 107.7 | 65% | 0.652 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -74.6 | -32.6 | 178.7 | -81.4 | -8.7 | 0 | 0 | 0 | 113.1 | V167 A172 T173 | V167-N169 VanDerWaalsContact C-N 3.27Å; V167-N169 PolarHBondContact O-N 2.9Å; N169-A172 PolarHBondContact O-N 2.89Å; N169-T173 PolarHBondContact O-N 2.97Å; N169-T173 PolarHBondContact O-OG1 2.93Å; N169-T173 VanDerWaalsContact O-OG1 3.09Å |
| 170 | I | 55.4 | Low | 53.5 | Low | 117 Ų | 117 | 104.5 Ų | 104.5 | 60% | 0.6 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -68.4 | -38.3 | -179.8 | -63.7 | 174 | 0 | 0 | 0 | 110.6 | V167 T173 | V167-I170 PolarHBondContact O-N 3.21Å; I170-T173 PolarHBondContact O-OG1 3.19Å |
| 171 | V | 52.5 | Low | 55.6 | Low | 107 Ų | 107 | 101.3 Ų | 101.3 | 65% | 0.648 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -70.9 | -34.1 | 178.4 | -179.3 | 0 | 0 | 0 | 0 | 111.7 | V167 T173 | V167-V171 PolarHBondContact O-N 3.28Å; V171-T173 PolarHBondContact O-N 2.95Å |
| 172 | A | 51.2 | Low | 57.9 | Low | 68 Ų | 68 | 94.7 Ų | 94.7 | 56% | 0.562 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -69.3 | -33 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | S168 N169 C174 | S168-A172 PolarHBondContact O-N 3.42Å; N169-A172 PolarHBondContact O-N 2.89Å; A172-C174 VanDerWaalsContact C-N 3.32Å; A172-C174 PolarHBondContact O-N 3.31Å |
| 173 | T | 52.2 | Low | 60.2 | Low | 109 Ų | 109 | 92.6 Ų | 92.6 | 67% | 0.669 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -72.4 | -17.5 | -179.4 | 25.5 | 0 | 0 | 0 | 0 | 115 | N169 I170 V171 | N169-T173 PolarHBondContact O-N 2.97Å; N169-T173 PolarHBondContact O-OG1 2.93Å; N169-T173 VanDerWaalsContact O-OG1 3.09Å; I170-T173 PolarHBondContact O-OG1 3.19Å; V171-T173 PolarHBondContact O-N 2.95Å |
| 174 | C | 51.3 | Low | 62.5 | Low | 95 Ų | 95 | 90.8 Ų | 90.8 | 64% | 0.642 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -78.9 | -24.1 | -179.1 | -65.3 | 0 | 0 | 0 | 0 | 113.6 | A172 | A172-C174 VanDerWaalsContact C-N 3.32Å; A172-C174 PolarHBondContact O-N 3.31Å |
| 175 | A | 53.4 | Low | 64.9 | Low | 70 Ų | 70 | 87.9 Ų | 87.9 | 58% | 0.579 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -76.2 | -32.9 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | G177 | A175-G177 VanDerWaalsContact C-N 3.26Å; A175-G177 PolarHBondContact O-N 3.31Å |
| 176 | A | 55 | Low | 67.1 | Low | 89 Ų | 89 | 80.9 Ų | 80.9 | 74% | 0.736 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75 | -10.2 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 177 | G | 59.6 | Low | 69.4 | Low | 48 Ų | 48 | 84.8 Ų | 84.8 | 50% | 0.495 | 52% | 0.521 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.5 | -15.1 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | A175 | A175-G177 VanDerWaalsContact C-N 3.26Å; A175-G177 PolarHBondContact O-N 3.31Å |
| 178 | L | 64.4 | Low | 71.4 | Confident | 109 Ų | 109 | 82.6 Ų | 82.6 | 57% | 0.571 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -82.6 | -32.5 | -170.4 | -71.8 | 169.1 | 0 | 0 | 0 | 113.9 | G180 T181 M182 | L178-G180 VanDerWaalsContact C-N 3.28Å; L178-G180 PolarHBondContact O-N 2.98Å; L178-T181 PolarHBondContact O-N 3.16Å; L178-T181 VanDerWaalsContact O-N 3.15Å; L178-T181 PolarHBondContact O-OG1 3.02Å; L178-M182 PolarHBondContact O-N 2.99Å |
| 179 | D | 69.8 | Low | 73.5 | Confident | 135 Ų | 135 | 79.6 Ų | 79.6 | 72% | 0.722 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66 | -34.7 | -177.5 | -70.8 | -17.5 | 0 | 0 | 0 | 112.1 | T181 | D179-T181 VanDerWaalsContact C-N 3.34Å; D179-T181 PolarHBondContact O-N 3.48Å |
| 180 | G | 80.9 | Confident | 75.8 | Confident | 49 Ų | 49 | 77.4 Ų | 77.4 | 51% | 0.505 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.3 | -35.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113 | L178 T184 | L178-G180 VanDerWaalsContact C-N 3.28Å; L178-G180 PolarHBondContact O-N 2.98Å; G180-T184 VanDerWaalsContact O-CG2 3.28Å; G180-T184 WeakPolarHBondContact O-CG2 3.47Å; G180-T184 PolarHBondContact O-N 3.44Å; G180-T184 PolarHBondContact O-OG1 3.4Å |
| 181 | T | 88.8 | Confident | 77.8 | Confident | 57 Ų | 57 | 77.4 Ų | 77.4 | 35% | 0.35 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -72.3 | -40.6 | -177.8 | 64 | 0 | 0 | 0 | 0 | 111.1 | L178 D179 E183 T184 I185 | L178-T181 PolarHBondContact O-N 3.16Å; L178-T181 VanDerWaalsContact O-N 3.15Å; L178-T181 PolarHBondContact O-OG1 3.02Å; D179-T181 VanDerWaalsContact C-N 3.34Å; D179-T181 PolarHBondContact O-N 3.48Å; T181-E183 PolarHBondContact O-N 3.16Å; T181-T184 WeakPolarHBondContact CA-OG1 3.45Å; T181-T184 PolarHBondContact O-N 3.18Å; T181-T184 PolarHBondContact O-OG1 2.82Å; T181-I185 VanDerWaalsContact O-CG1 3.3Å; T181-I185 WeakPolarHBondContact O-CG1 3.49Å; T181-I185 PolarHBondContact O-N 3.36Å |
| 182 | M | 91.9 | Very high | 80 | Confident | 25 Ų | 25 | 72.9 Ų | 72.9 | 12% | 0.123 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -61.2 | -45.9 | -179.5 | -177 | 50 | 157 | 0 | 0 | 112.4 | L178 T184 I185 K186 F238 V241 L242 | L178-M182 PolarHBondContact O-N 2.99Å; M182-T184 VanDerWaalsContact C-N 3.32Å; M182-T184 PolarHBondContact O-N 3.35Å; M182-I185 PolarHBondContact O-N 2.9Å; M182-K186 HydrophobicContact CG-CD 4.46Å; M182-K186 WeakPolarHBondContact O-CG 3.34Å; M182-K186 PolarHBondContact O-N 3.21Å; M182-K186 HydrophobicContact SD-CG 4.33Å; M182-F238 HydrophobicContact CE-CD2 4.15Å; M182-F238 HydrophobicContact CE-CE2 3.34Å; M182-F238 HydrophobicContact CE-CZ 3.77Å; M182-F238 HydrophobicContact SD-CD2 4.13Å; M182-F238 HydrophobicContact SD-CE2 3.78Å; M182-V241 HydrophobicContact CB-CG1 4.25Å; M182-V241 HydrophobicContact CG-CG1 4.47Å; M182-V241 HydrophobicContact SD-CB 4.49Å; M182-V241 HydrophobicContact SD-CG1 3.68Å; M182-L242 HydrophobicContact CE-CD2 3.34Å; M182-L242 HydrophobicContact CE-CG 3.9Å |
| 183 | E | 92.7 | Very high | 82.2 | Confident | 89 Ų | 89 | 72 Ų | 72 | 42% | 0.416 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -66.4 | -34.2 | 178.3 | -69.4 | -54.6 | 130.5 | 0 | 0 | 112.6 | T181 K186 K187 | T181-E183 PolarHBondContact O-N 3.16Å; E183-K186 WeakPolarHBondContact OE1-CD 3.44Å; E183-K186 IonicContact OE1-NZ 3.12Å; E183-K186 PolarHBondContact OE1-NZ 3.44Å; E183-K187 VanDerWaalsContact O-CG 3.29Å; E183-K187 WeakPolarHBondContact O-CG 3.38Å; E183-K187 PolarHBondContact O-N 3.37Å; E183-K187 VanDerWaalsContact O-N 3.14Å |
| 184 | T | 94.5 | Very high | 84.4 | Confident | 85 Ų | 85 | 71 Ų | 71 | 52% | 0.521 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66 | -40.3 | 173.7 | 61.2 | 0 | 0 | 0 | 0 | 112.2 | G180 T181 M182 K187 A188 | G180-T184 VanDerWaalsContact O-CG2 3.28Å; G180-T184 WeakPolarHBondContact O-CG2 3.47Å; G180-T184 PolarHBondContact O-N 3.44Å; G180-T184 PolarHBondContact O-OG1 3.4Å; T181-T184 WeakPolarHBondContact CA-OG1 3.45Å; T181-T184 PolarHBondContact O-N 3.18Å; T181-T184 PolarHBondContact O-OG1 2.82Å; M182-T184 VanDerWaalsContact C-N 3.32Å; M182-T184 PolarHBondContact O-N 3.35Å; T184-K187 PolarHBondContact O-N 3.18Å; T184-A188 WeakPolarHBondContact O-CB 3.29Å; T184-A188 PolarHBondContact O-N 3.46Å |
| 185 | I | 94.9 | Very high | 86.6 | Confident | 24 Ų | 24 | 68.1 Ų | 68.1 | 12% | 0.123 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -70.8 | -40.1 | 179.6 | -64.3 | 164 | 0 | 0 | 0 | 110.8 | T181 M182 K187 A188 R189 F238 V241 | T181-I185 VanDerWaalsContact O-CG1 3.3Å; T181-I185 WeakPolarHBondContact O-CG1 3.49Å; T181-I185 PolarHBondContact O-N 3.36Å; M182-I185 PolarHBondContact O-N 2.9Å; I185-K187 VanDerWaalsContact C-N 3.29Å; I185-K187 PolarHBondContact O-N 3.28Å; I185-A188 PolarHBondContact O-N 3.01Å; I185-R189 VanDerWaalsContact O-CB 3.25Å; I185-R189 WeakPolarHBondContact O-CB 3.44Å; I185-R189 PolarHBondContact O-N 3.47Å; I185-F238 HydrophobicContact CG2-CB 3.83Å; I185-F238 HydrophobicContact CG2-CD2 3.99Å; I185-F238 HydrophobicContact CG2-CG 4.43Å; I185-V241 HydrophobicContact CD1-CB 4.14Å; I185-V241 HydrophobicContact CD1-CG1 4.46Å; I185-V241 HydrophobicContact CD1-CG2 3.36Å |
| 186 | K | 95.8 | Very high | 88.7 | Confident | 80 Ų | 80 | 65 Ų | 65 | 35% | 0.348 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -56.9 | -43.4 | 172.7 | -75.1 | 176.1 | -173.7 | 168.6 | 0 | 111.8 | M182 E183 T190 F238 | M182-K186 HydrophobicContact CG-CD 4.46Å; M182-K186 WeakPolarHBondContact O-CG 3.34Å; M182-K186 PolarHBondContact O-N 3.21Å; M182-K186 HydrophobicContact SD-CG 4.33Å; E183-K186 WeakPolarHBondContact OE1-CD 3.44Å; E183-K186 IonicContact OE1-NZ 3.12Å; E183-K186 PolarHBondContact OE1-NZ 3.44Å; K186-T190 WeakPolarHBondContact O-CB 3.3Å; K186-T190 PolarHBondContact O-N 2.91Å; K186-T190 PolarHBondContact O-OG1 3.4Å; K186-F238 HydrophobicContact CG-CD2 4.32Å; K186-F238 HydrophobicContact CG-CE2 3.64Å |
| 187 | K | 96.6 | Very high | 90.8 | Very high | 136 Ų | 136 | 62 Ų | 62 | 59% | 0.591 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -65.3 | -48.6 | 176.7 | -71.6 | 171.4 | -175 | 176.7 | 0 | 111.4 | E183 T184 I185 R189 T190 I191 | E183-K187 VanDerWaalsContact O-CG 3.29Å; E183-K187 WeakPolarHBondContact O-CG 3.38Å; E183-K187 PolarHBondContact O-N 3.37Å; E183-K187 VanDerWaalsContact O-N 3.14Å; T184-K187 PolarHBondContact O-N 3.18Å; I185-K187 VanDerWaalsContact C-N 3.29Å; I185-K187 PolarHBondContact O-N 3.28Å; K187-R189 PolarHBondContact O-N 2.95Å; K187-T190 PolarHBondContact O-N 2.98Å; K187-I191 WeakPolarHBondContact O-CG1 3.48Å; K187-I191 PolarHBondContact O-N 3.19Å |
| 188 | A | 96.8 | Very high | 92.6 | Very high | 35 Ų | 35 | 68.9 Ų | 68.9 | 29% | 0.289 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -58.2 | -47.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | T184 I185 T190 I191 A192 | T184-A188 WeakPolarHBondContact O-CB 3.29Å; T184-A188 PolarHBondContact O-N 3.46Å; I185-A188 PolarHBondContact O-N 3.01Å; A188-T190 VanDerWaalsContact C-N 3.34Å; A188-T190 PolarHBondContact O-N 3.37Å; A188-I191 PolarHBondContact O-N 2.78Å; A188-A192 PolarHBondContact O-N 2.97Å |
| 189 | R | 96.3 | Very high | 94.2 | Very high | 23 Ų | 23 | 64 Ų | 64 | 9% | 0.087 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -56.7 | -45 | 174.3 | -176.1 | -171.4 | -175.7 | -164.7 | 16.4 | 112 | I185 K187 I191 A192 R193 E235 F238 A255 | I185-R189 VanDerWaalsContact O-CB 3.25Å; I185-R189 WeakPolarHBondContact O-CB 3.44Å; I185-R189 PolarHBondContact O-N 3.47Å; K187-R189 PolarHBondContact O-N 2.95Å; R189-I191 PolarHBondContact O-N 3.47Å; R189-A192 PolarHBondContact O-N 3.01Å; R189-R193 VanDerWaalsContact CZ-CZ 3.43Å; R189-R193 VanDerWaalsContact NE-CZ 3.27Å; R189-R193 WeakPolarHBondContact O-CB 3.49Å; R189-R193 VanDerWaalsContact O-CG 3.31Å; R189-R193 WeakPolarHBondContact O-CG 3.23Å; R189-R193 PolarHBondContact O-N 2.85Å; R189-E235 IonicContact CZ-OE1 2.74Å; R189-E235 IonicContact CZ-OE2 3.68Å; R189-E235 IonicContact NE-OE1 3.16Å; R189-E235 PolarHBondContact NE-OE1 2.86Å; R189-E235 IonicContact NE-OE2 2.95Å; R189-E235 PolarHBondContact NE-OE2 3.19Å; R189-E235 IonicContact NH2-OE1 2.76Å; R189-E235 IonicContact NH2-OE2 3.58Å; R189-E235 PolarHBondContact NH2-OE2 3.46Å; R189-F238 VanDerWaalsContact CZ-CD1 3.43Å; R189-F238 VanDerWaalsContact NH1-CD1 3.28Å; R189-A255 PolarHBondContact NH2-O 3.17Å |
| 190 | T | 97.3 | Very high | 95.5 | Very high | 75 Ų | 75 | 57.6 Ų | 57.6 | 46% | 0.46 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.3 | -41.3 | 179 | -57.8 | 0 | 0 | 0 | 0 | 111.7 | K186 K187 A188 R193 N194 | K186-T190 WeakPolarHBondContact O-CB 3.3Å; K186-T190 PolarHBondContact O-N 2.91Å; K186-T190 PolarHBondContact O-OG1 3.4Å; K187-T190 PolarHBondContact O-N 2.98Å; A188-T190 VanDerWaalsContact C-N 3.34Å; A188-T190 PolarHBondContact O-N 3.37Å; T190-R193 PolarHBondContact O-N 3.24Å; T190-N194 WeakPolarHBondContact O-CB 3.49Å; T190-N194 VanDerWaalsContact O-CG 3.24Å; T190-N194 PolarHBondContact O-N 2.97Å; T190-N194 PolarHBondContact O-ND2 3.49Å |
| 191 | I | 97.9 | Very high | 96.3 | Very high | 118 Ų | 118 | 61.8 Ų | 61.8 | 61% | 0.605 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -63 | -46.2 | 175.5 | -66 | 164.2 | 0 | 0 | 0 | 110.4 | K187 A188 R189 N194 A195 | K187-I191 WeakPolarHBondContact O-CG1 3.48Å; K187-I191 PolarHBondContact O-N 3.19Å; A188-I191 PolarHBondContact O-N 2.78Å; R189-I191 PolarHBondContact O-N 3.47Å; I191-N194 PolarHBondContact O-N 3.49Å; I191-A195 WeakPolarHBondContact O-CB 3.36Å; I191-A195 PolarHBondContact O-N 2.89Å |
| 192 | A | 97.8 | Very high | 96.8 | Very high | 12 Ų | 12 | 65 Ų | 65 | 10% | 0.099 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.6 | -45.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A188 R189 N194 A195 F196 L231 E234 | A188-A192 PolarHBondContact O-N 2.97Å; R189-A192 PolarHBondContact O-N 3.01Å; A192-N194 VanDerWaalsContact C-N 3.34Å; A192-N194 PolarHBondContact O-N 2.85Å; A192-A195 PolarHBondContact O-N 3.12Å; A192-F196 WeakPolarHBondContact O-CB 3.39Å; A192-F196 PolarHBondContact O-N 3.33Å; A192-L231 HydrophobicContact CB-CD1 4Å; A192-E234 HydrophobicContact CB-CB 4.49Å; A192-E234 HydrophobicContact CB-CG 4.33Å |
| 193 | R | 97.7 | Very high | 97 | Very high | 49 Ų | 49 | 63.8 Ų | 63.8 | 19% | 0.185 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.4 | -43.3 | 175.9 | -76.5 | 174.7 | 171.5 | -162.7 | -18 | 112.5 | R189 T190 F196 S197 L231 E235 Y262 | R189-R193 VanDerWaalsContact CZ-CZ 3.43Å; R189-R193 VanDerWaalsContact NE-CZ 3.27Å; R189-R193 WeakPolarHBondContact O-CB 3.49Å; R189-R193 VanDerWaalsContact O-CG 3.31Å; R189-R193 WeakPolarHBondContact O-CG 3.23Å; R189-R193 PolarHBondContact O-N 2.85Å; T190-R193 PolarHBondContact O-N 3.24Å; R193-F196 PolarHBondContact O-N 3.28Å; R193-S197 VanDerWaalsContact O-CB 3.27Å; R193-S197 WeakPolarHBondContact O-CB 3.32Å; R193-S197 PolarHBondContact O-N 3.33Å; R193-S197 PolarHBondContact O-OG 2.94Å; R193-L231 HydrophobicContact CB-CD1 4.42Å; R193-L231 HydrophobicContact CG-CD1 3.55Å; R193-E235 IonicContact CZ-OE1 2.83Å; R193-E235 IonicContact NE-OE1 3.63Å; R193-E235 PolarHBondContact NE-OE1 3.21Å; R193-E235 IonicContact NH2-OE1 3.13Å; R193-E235 PolarHBondContact NH2-OE1 3.4Å; R193-E235 IonicContact NH2-OE2 2.73Å; R193-Y262 HydrophobicContact CG-CE2 4.26Å |
| 194 | N | 98.1 | Very high | 97.2 | Very high | 87 Ų | 87 | 62.9 Ų | 62.9 | 47% | 0.465 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -65.9 | -41.5 | 178 | -74.4 | -26.2 | 0 | 0 | 0 | 111.3 | T190 I191 A192 S197 R198 | T190-N194 WeakPolarHBondContact O-CB 3.49Å; T190-N194 VanDerWaalsContact O-CG 3.24Å; T190-N194 PolarHBondContact O-N 2.97Å; T190-N194 PolarHBondContact O-ND2 3.49Å; I191-N194 PolarHBondContact O-N 3.49Å; A192-N194 VanDerWaalsContact C-N 3.34Å; A192-N194 PolarHBondContact O-N 2.85Å; N194-S197 PolarHBondContact O-N 2.9Å; N194-R198 VanDerWaalsContact O-CG 3.28Å; N194-R198 WeakPolarHBondContact O-CG 3.28Å; N194-R198 PolarHBondContact O-N 3.18Å |
| 195 | A | 98 | Very high | 97.4 | Very high | 35 Ų | 35 | 61.7 Ų | 61.7 | 29% | 0.289 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.9 | -47 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I191 A192 R198 A199 | I191-A195 WeakPolarHBondContact O-CB 3.36Å; I191-A195 PolarHBondContact O-N 2.89Å; A192-A195 PolarHBondContact O-N 3.12Å; A195-R198 PolarHBondContact O-N 3.17Å; A195-A199 PolarHBondContact O-N 3.27Å |
| 196 | F | 98.4 | Very high | 97.4 | Very high | 4 Ų | 4 | 62.7 Ų | 62.7 | 2% | 0.018 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -59.6 | -47.3 | 175.3 | 177.3 | -101.7 | 0 | 0 | 0 | 111.5 | A192 R193 R198 A199 C200 M224 K227 L231 Y262 W266 | A192-F196 WeakPolarHBondContact O-CB 3.39Å; A192-F196 PolarHBondContact O-N 3.33Å; R193-F196 PolarHBondContact O-N 3.28Å; F196-R198 VanDerWaalsContact C-N 3.28Å; F196-R198 PolarHBondContact O-N 3.34Å; F196-A199 WeakPolarHBondContact O-CB 3.33Å; F196-A199 PolarHBondContact O-N 3.31Å; F196-C200 WeakPolarHBondContact CE1-SG 3.46Å; F196-C200 WeakPolarHBondContact CZ-SG 3.37Å; F196-C200 PolarHBondContact O-N 2.93Å; F196-C200 PolarHBondContact O-SG 3.5Å; F196-C200 VanDerWaalsContact O-SG 3.39Å; F196-M224 HydrophobicContact CE2-CG 4.02Å; F196-K227 HydrophobicContact CD2-CB 4.48Å; F196-L231 HydrophobicContact CB-CD2 3.93Å; F196-L231 HydrophobicContact CD1-CD2 3.79Å; F196-L231 HydrophobicContact CD2-CD2 4.43Å; F196-L231 HydrophobicContact CE1-CD2 4.45Å; F196-L231 HydrophobicContact CG-CD2 3.78Å; F196-Y262 AromaticContact CD1-CD1 3.82Å; F196-Y262 HydrophobicContact CD1-CD1 3.82Å; F196-Y262 HydrophobicContact CD1-CE1 4.48Å; F196-Y262 AromaticContact CE1-CD1 3.89Å; F196-Y262 HydrophobicContact CE1-CD1 3.89Å; F196-W266 HydrophobicContact CE2-CB 4.31Å; F196-W266 HydrophobicContact CE2-CG 4.43Å; F196-W266 HydrophobicContact CZ-CB 3.81Å; F196-W266 HydrophobicContact CZ-CG 4.4Å |
| 197 | S | 97.8 | Very high | 97.4 | Very high | 28 Ų | 28 | 60.9 Ų | 60.9 | 20% | 0.196 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.5 | -35.2 | 179.1 | -60.9 | 0 | 0 | 0 | 0 | 112.9 | R193 N194 K201 | R193-S197 VanDerWaalsContact O-CB 3.27Å; R193-S197 WeakPolarHBondContact O-CB 3.32Å; R193-S197 PolarHBondContact O-N 3.33Å; R193-S197 PolarHBondContact O-OG 2.94Å; N194-S197 PolarHBondContact O-N 2.9Å; S197-K201 WeakPolarHBondContact O-CG 3.42Å; S197-K201 PolarHBondContact O-N 2.83Å; S197-K201 VanDerWaalsContact O-N 3.1Å |
| 198 | R | 98.2 | Very high | 97.4 | Very high | 191 Ų | 191 | 58.4 Ų | 58.4 | 72% | 0.721 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -67.8 | -41.8 | 173.2 | -71.6 | 174.3 | -166.5 | -160.4 | 4.2 | 111.6 | N194 A195 F196 K201 R202 | N194-R198 VanDerWaalsContact O-CG 3.28Å; N194-R198 WeakPolarHBondContact O-CG 3.28Å; N194-R198 PolarHBondContact O-N 3.18Å; A195-R198 PolarHBondContact O-N 3.17Å; F196-R198 VanDerWaalsContact C-N 3.28Å; F196-R198 PolarHBondContact O-N 3.34Å; R198-K201 PolarHBondContact O-N 3.01Å; R198-R202 PolarHBondContact O-N 3.4Å |
| 199 | A | 98 | Very high | 97.3 | Very high | 8 Ų | 8 | 58.7 Ų | 58.7 | 7% | 0.066 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | A195 F196 K201 R202 L203 M224 K227 | A195-A199 PolarHBondContact O-N 3.27Å; F196-A199 WeakPolarHBondContact O-CB 3.33Å; F196-A199 PolarHBondContact O-N 3.31Å; A199-K201 PolarHBondContact O-N 3.23Å; A199-R202 PolarHBondContact O-N 2.95Å; A199-L203 PolarHBondContact O-N 3.42Å; A199-M224 HydrophobicContact CB-CB 4.39Å; A199-K227 HydrophobicContact CB-CG 4.48Å |
| 200 | C | 97.7 | Very high | 97 | Very high | 0 Ų | 0 | 65.3 Ų | 65.3 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -59.2 | -47.5 | 173.9 | -67.6 | 0 | 0 | 0 | 0 | 112.2 | F196 R202 L203 E204 L269 | F196-C200 WeakPolarHBondContact CE1-SG 3.46Å; F196-C200 WeakPolarHBondContact CZ-SG 3.37Å; F196-C200 PolarHBondContact O-N 2.93Å; F196-C200 PolarHBondContact O-SG 3.5Å; F196-C200 VanDerWaalsContact O-SG 3.39Å; C200-R202 VanDerWaalsContact C-N 3.26Å; C200-R202 PolarHBondContact O-N 3.23Å; C200-L203 PolarHBondContact O-N 3.05Å; C200-E204 WeakPolarHBondContact O-CB 3.44Å; C200-E204 VanDerWaalsContact O-CG 3.27Å; C200-E204 WeakPolarHBondContact O-CG 3.25Å; C200-E204 PolarHBondContact O-N 3.18Å; C200-L269 HydrophobicContact CB-CD1 3.65Å |
| 201 | K | 98.2 | Very high | 96.5 | Very high | 137 Ų | 137 | 67 Ų | 67 | 60% | 0.596 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -61.1 | -36.5 | 178.2 | -74.8 | 177.7 | -178.7 | -173.7 | 0 | 112.5 | S197 R198 A199 A205 | S197-K201 WeakPolarHBondContact O-CG 3.42Å; S197-K201 PolarHBondContact O-N 2.83Å; S197-K201 VanDerWaalsContact O-N 3.1Å; R198-K201 PolarHBondContact O-N 3.01Å; A199-K201 PolarHBondContact O-N 3.23Å; K201-A205 WeakPolarHBondContact O-CB 3.39Å; K201-A205 PolarHBondContact O-N 3.33Å |
| 202 | R | 97.6 | Very high | 96.2 | Very high | 123 Ų | 123 | 63.4 Ų | 63.4 | 46% | 0.464 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.5 | -50.6 | 175.8 | -172.2 | 172.2 | -179.6 | 173.3 | -4.3 | 110.7 | R198 A199 C200 E204 A205 E206 | R198-R202 PolarHBondContact O-N 3.4Å; A199-R202 PolarHBondContact O-N 2.95Å; C200-R202 VanDerWaalsContact C-N 3.26Å; C200-R202 PolarHBondContact O-N 3.23Å; R202-E204 VanDerWaalsContact C-N 3.32Å; R202-E204 PolarHBondContact O-N 3.33Å; R202-A205 WeakPolarHBondContact O-CB 3.47Å; R202-A205 PolarHBondContact O-N 3.5Å; R202-E206 WeakPolarHBondContact O-CG 3.33Å; R202-E206 PolarHBondContact O-N 3.21Å |
| 203 | L | 97.3 | Very high | 96 | Very high | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -61 | -40 | 176.9 | -177.7 | 63.2 | 0 | 0 | 0 | 112.3 | A199 C200 A205 E206 L207 V217 L221 M224 L269 A273 | A199-L203 PolarHBondContact O-N 3.42Å; C200-L203 PolarHBondContact O-N 3.05Å; L203-A205 VanDerWaalsContact C-N 3.28Å; L203-A205 PolarHBondContact O-N 3.5Å; L203-E206 PolarHBondContact O-N 2.76Å; L203-L207 HydrophobicContact CD1-CD1 4.33Å; L203-L207 HydrophobicContact CD1-CG 4.28Å; L203-L207 HydrophobicContact CG-CD1 4.04Å; L203-L207 HydrophobicContact CG-CG 4.42Å; L203-L207 WeakPolarHBondContact O-CB 3.48Å; L203-L207 VanDerWaalsContact O-CG 3.26Å; L203-L207 WeakPolarHBondContact O-CG 3.31Å; L203-L207 PolarHBondContact O-N 3.4Å; L203-V217 HydrophobicContact CD1-CG1 4.16Å; L203-L221 HydrophobicContact CD2-CD1 4.35Å; L203-M224 HydrophobicContact CD2-CE 3.57Å; L203-M224 HydrophobicContact CD2-SD 3.63Å; L203-L269 HydrophobicContact CD2-CB 4.15Å; L203-A273 HydrophobicContact CD1-CB 4.46Å |
| 204 | E | 97.4 | Very high | 95.8 | Very high | 70 Ų | 70 | 66.7 Ų | 66.7 | 33% | 0.327 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.6 | -36.9 | 173.8 | -75.5 | 167.5 | -175.3 | 0 | 0 | 111.9 | C200 R202 A208 R265 L269 | C200-E204 WeakPolarHBondContact O-CB 3.44Å; C200-E204 VanDerWaalsContact O-CG 3.27Å; C200-E204 WeakPolarHBondContact O-CG 3.25Å; C200-E204 PolarHBondContact O-N 3.18Å; R202-E204 VanDerWaalsContact C-N 3.32Å; R202-E204 PolarHBondContact O-N 3.33Å; E204-A208 VanDerWaalsContact O-CB 3.3Å; E204-A208 WeakPolarHBondContact O-CB 3.45Å; E204-A208 PolarHBondContact O-N 3.42Å; E204-A208 VanDerWaalsContact O-N 3.15Å; E204-R265 IonicContact OE1-CZ 2.7Å; E204-R265 IonicContact OE1-NE 3.5Å; E204-R265 PolarHBondContact OE1-NE 3.36Å; E204-R265 IonicContact OE1-NH2 3.95Å; E204-R265 PolarHBondContact OE1-NH2 3.15Å; E204-R265 IonicContact OE2-NH2 2.82Å; E204-R265 PolarHBondContact OE2-NH2 3.35Å; E204-R265 VanDerWaalsContact OE2-NH2 3.12Å; E204-L269 HydrophobicContact CG-CD1 4.24Å; E204-L269 HydrophobicContact CG-CD2 3.47Å; E204-L269 VanDerWaalsContact CG-CD2 3.47Å |
| 205 | A | 97.5 | Very high | 95.7 | Very high | 60 Ų | 60 | 68 Ų | 68 | 50% | 0.496 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -70.8 | -43.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | K201 R202 L203 L207 A208 A209 | K201-A205 WeakPolarHBondContact O-CB 3.39Å; K201-A205 PolarHBondContact O-N 3.33Å; R202-A205 WeakPolarHBondContact O-CB 3.47Å; R202-A205 PolarHBondContact O-N 3.5Å; L203-A205 VanDerWaalsContact C-N 3.28Å; L203-A205 PolarHBondContact O-N 3.5Å; A205-L207 VanDerWaalsContact C-N 3.33Å; A205-L207 PolarHBondContact O-N 2.86Å; A205-A208 PolarHBondContact O-N 2.89Å; A205-A208 VanDerWaalsContact O-N 3.16Å; A205-A209 PolarHBondContact O-N 2.73Å; A205-A209 VanDerWaalsContact O-N 3.17Å |
| 206 | E | 95.5 | Very high | 95.6 | Very high | 45 Ų | 45 | 70 Ų | 70 | 21% | 0.21 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64.2 | -38 | 176.5 | -56.5 | -52.1 | 163 | 0 | 0 | 111.7 | R202 L203 A208 A209 V217 | R202-E206 WeakPolarHBondContact O-CG 3.33Å; R202-E206 PolarHBondContact O-N 3.21Å; L203-E206 PolarHBondContact O-N 2.76Å; E206-A208 VanDerWaalsContact C-N 3.27Å; E206-A208 PolarHBondContact O-N 3.5Å; E206-A209 WeakPolarHBondContact O-CB 3.36Å; E206-A209 PolarHBondContact O-N 2.7Å; E206-V217 HydrophobicContact CB-CG2 3.91Å |
| 207 | L | 95.5 | Very high | 95.5 | Very high | 43 Ų | 43 | 69.8 Ų | 69.8 | 23% | 0.225 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -71.6 | -20.5 | 175.9 | -71 | 174 | 0 | 0 | 0 | 113.5 | L203 A205 V217 A272 A273 C276 | L203-L207 HydrophobicContact CD1-CD1 4.33Å; L203-L207 HydrophobicContact CD1-CG 4.28Å; L203-L207 HydrophobicContact CG-CD1 4.04Å; L203-L207 HydrophobicContact CG-CG 4.42Å; L203-L207 WeakPolarHBondContact O-CB 3.48Å; L203-L207 VanDerWaalsContact O-CG 3.26Å; L203-L207 WeakPolarHBondContact O-CG 3.31Å; L203-L207 PolarHBondContact O-N 3.4Å; A205-L207 VanDerWaalsContact C-N 3.33Å; A205-L207 PolarHBondContact O-N 2.86Å; L207-V217 HydrophobicContact CD2-CG1 3.98Å; L207-V217 HydrophobicContact CD2-CG2 4.13Å; L207-A272 HydrophobicContact CD1-CB 4.15Å; L207-A273 HydrophobicContact CD1-CB 4.44Å; L207-A273 HydrophobicContact CD2-CB 4.39Å; L207-C276 HydrophobicContact CD2-CB 4.04Å |
| 208 | A | 96 | Very high | 95.5 | Very high | 83 Ų | 83 | 73.2 Ų | 73.2 | 69% | 0.686 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -90.7 | -10.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | E204 A205 E206 | E204-A208 VanDerWaalsContact O-CB 3.3Å; E204-A208 WeakPolarHBondContact O-CB 3.45Å; E204-A208 PolarHBondContact O-N 3.42Å; E204-A208 VanDerWaalsContact O-N 3.15Å; A205-A208 PolarHBondContact O-N 2.89Å; A205-A208 VanDerWaalsContact O-N 3.16Å; E206-A208 VanDerWaalsContact C-N 3.27Å; E206-A208 PolarHBondContact O-N 3.5Å |
| 209 | A | 94.3 | Very high | 95.5 | Very high | 41 Ų | 41 | 68.4 Ų | 68.4 | 34% | 0.339 | 38% | 0.378 | S | S | . | . | S | Bend | trans | -68.5 | 141.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | A205 E206 P211 P212 | A205-A209 PolarHBondContact O-N 2.73Å; A205-A209 VanDerWaalsContact O-N 3.17Å; E206-A209 WeakPolarHBondContact O-CB 3.36Å; E206-A209 PolarHBondContact O-N 2.7Å; A209-P211 CarbonylContact O-C 3.41Å; A209-P212 WeakPolarHBondContact O-CD 3.45Å; A209-P212 VanDerWaalsContact O-N 3.13Å |
| 210 | D | 90.7 | Very high | 95.4 | Very high | 162 Ų | 162 | 68 Ų | 68 | 87% | 0.866 | 38% | 0.375 | S | S | * | . | S | Bend | trans | -123.7 | 108.5 | 179.2 | -171.1 | 10.1 | 0 | 0 | 0 | 109.9 | ||
| 211 | P | 88 | Confident | 95.4 | Very high | 111 Ų | 111 | 68.8 Ų | 68.8 | 72% | 0.721 | 38% | 0.379 | S | S | * | . | S | Bend | cis | -78.3 | 149.2 | -4.7 | 32.1 | -34.2 | 0 | 0 | 0 | 112.8 | A209 | A209-P211 CarbonylContact O-C 3.41Š|
| 212 | P | 90.6 | Very high | 95.4 | Very high | 42 Ų | 42 | 65.5 Ų | 65.5 | 27% | 0.273 | 37% | 0.374 | S | S | . | . | trans | -71.2 | 132.1 | 176.5 | 27.8 | -32.4 | 0 | 0 | 0 | 110.7 | A209 L214 V217 | A209-P212 WeakPolarHBondContact O-CD 3.45Å; A209-P212 VanDerWaalsContact O-N 3.13Å; P212-L214 PolarHBondContact O-N 3.22Å; P212-V217 HydrophobicContact CB-CG2 4.46Å | ||
| 213 | D | 93.6 | Very high | 95.4 | Very high | 86 Ų | 86 | 62.5 Ų | 62.5 | 46% | 0.46 | 37% | 0.365 | S | S | . | . | trans | -76.6 | 113.2 | 172.5 | -174.1 | -7.6 | 0 | 0 | 0 | 109.7 | D215 E216 V217 | D213-D215 VanDerWaalsContact C-N 3.28Å; D213-D215 PolarHBondContact O-N 3.08Å; D213-D215 PolarHBondContact OD1-N 3.27Å; D213-D215 VanDerWaalsContact OD1-N 3.14Å; D213-E216 HydrophobicContact CB-CB 4.12Å; D213-E216 HydrophobicContact CB-CG 4.29Å; D213-E216 PolarHBondContact O-N 2.88Å; D213-V217 VanDerWaalsContact O-CG2 3.3Å; D213-V217 WeakPolarHBondContact O-CG2 3.48Å; D213-V217 PolarHBondContact O-N 3.02Å | ||
| 214 | L | 94 | Very high | 95.4 | Very high | 44 Ų | 44 | 62.5 Ų | 62.5 | 23% | 0.23 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.4 | -33.8 | -174.3 | -59.5 | 169 | 0 | 0 | 0 | 112.2 | P212 V217 Q218 D280 | P212-L214 PolarHBondContact O-N 3.22Å; L214-V217 PolarHBondContact O-N 2.77Å; L214-Q218 WeakPolarHBondContact O-CB 3.37Å; L214-Q218 PolarHBondContact O-N 3.05Å; L214-D280 HydrophobicContact CD1-CB 3.72Å; L214-D280 WeakPolarHBondContact CD1-OD2 3.43Å; L214-D280 HydrophobicContact CD2-CB 3.98Å; L214-D280 HydrophobicContact CG-CB 4.47Å |
| 215 | D | 95.5 | Very high | 95.4 | Very high | 116 Ų | 116 | 61.1 Ų | 61.1 | 62% | 0.62 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -69.1 | -44.7 | -179.5 | -70 | -25.4 | 0 | 0 | 0 | 109.5 | D213 Q218 V219 | D213-D215 VanDerWaalsContact C-N 3.28Å; D213-D215 PolarHBondContact O-N 3.08Å; D213-D215 PolarHBondContact OD1-N 3.27Å; D213-D215 VanDerWaalsContact OD1-N 3.14Å; D215-Q218 PolarHBondContact O-N 3.38Å; D215-V219 WeakPolarHBondContact O-CG2 3.43Å; D215-V219 PolarHBondContact O-N 3.47Å |
| 216 | E | 95.9 | Very high | 95.5 | Very high | 75 Ų | 75 | 64.3 Ų | 64.3 | 35% | 0.35 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66.3 | -38.2 | 175.4 | -72.9 | -67 | 165.4 | 0 | 0 | 112.5 | D213 V219 S220 | D213-E216 HydrophobicContact CB-CB 4.12Å; D213-E216 HydrophobicContact CB-CG 4.29Å; D213-E216 PolarHBondContact O-N 2.88Å; E216-V219 PolarHBondContact O-N 3.45Å; E216-S220 WeakPolarHBondContact O-CB 3.31Å; E216-S220 PolarHBondContact O-N 3.16Å; E216-S220 PolarHBondContact O-OG 3.13Å |
| 217 | V | 96.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.7 | -43.2 | 173.3 | 169.6 | 0 | 0 | 0 | 0 | 110.6 | L203 E206 L207 P212 D213 L214 S220 L221 A273 | L203-V217 HydrophobicContact CD1-CG1 4.16Å; E206-V217 HydrophobicContact CB-CG2 3.91Å; L207-V217 HydrophobicContact CD2-CG1 3.98Å; L207-V217 HydrophobicContact CD2-CG2 4.13Å; P212-V217 HydrophobicContact CB-CG2 4.46Å; D213-V217 VanDerWaalsContact O-CG2 3.3Å; D213-V217 WeakPolarHBondContact O-CG2 3.48Å; D213-V217 PolarHBondContact O-N 3.02Å; L214-V217 PolarHBondContact O-N 2.77Å; V217-S220 PolarHBondContact O-N 3.48Å; V217-L221 WeakPolarHBondContact O-CB 3.46Å; V217-L221 PolarHBondContact O-N 3.35Å; V217-A273 HydrophobicContact CG1-CB 4.07Å |
| 218 | Q | 96.9 | Very high | 95.7 | Very high | 101 Ų | 101 | 64.4 Ų | 64.4 | 47% | 0.472 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66.4 | -42.6 | 179.4 | -177.5 | 174.1 | -6.5 | 0 | 0 | 112.2 | L214 D215 S222 M277 | L214-Q218 WeakPolarHBondContact O-CB 3.37Å; L214-Q218 PolarHBondContact O-N 3.05Å; D215-Q218 PolarHBondContact O-N 3.38Å; Q218-S222 WeakPolarHBondContact O-CB 3.44Å; Q218-S222 PolarHBondContact O-N 3.36Å; Q218-S222 PolarHBondContact O-OG 3.26Å; Q218-M277 HydrophobicContact CB-SD 4.49Å |
| 219 | V | 97.8 | Very high | 95.7 | Very high | 89 Ų | 89 | 65.1 Ų | 65.1 | 54% | 0.539 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -64.2 | -46.2 | 175.1 | 172.1 | 0 | 0 | 0 | 0 | 110.3 | D215 E216 L221 S222 M223 | D215-V219 WeakPolarHBondContact O-CG2 3.43Å; D215-V219 PolarHBondContact O-N 3.47Å; E216-V219 PolarHBondContact O-N 3.45Å; V219-L221 PolarHBondContact O-N 3.16Å; V219-S222 PolarHBondContact O-N 3.05Å; V219-M223 WeakPolarHBondContact O-CB 3.47Å; V219-M223 PolarHBondContact O-N 2.95Å |
| 220 | S | 97.2 | Very high | 95.9 | Very high | 1 Ų | 1 | 66 Ų | 66 | 1% | 0.007 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -64 | -38.4 | 179 | -68.7 | 0 | 0 | 0 | 0 | 112.5 | E216 V217 M224 | E216-S220 WeakPolarHBondContact O-CB 3.31Å; E216-S220 PolarHBondContact O-N 3.16Å; E216-S220 PolarHBondContact O-OG 3.13Å; V217-S220 PolarHBondContact O-N 3.48Å; S220-M224 WeakPolarHBondContact O-CB 3.4Å; S220-M224 PolarHBondContact O-N 2.87Å |
| 221 | L | 97.6 | Very high | 96.2 | Very high | 15 Ų | 15 | 58.7 Ų | 58.7 | 8% | 0.079 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.9 | -45.7 | 173.7 | 177.6 | 59.7 | 0 | 0 | 0 | 111.5 | L203 V217 V219 M223 M224 N225 Q270 A273 M277 | L203-L221 HydrophobicContact CD2-CD1 4.35Å; V217-L221 WeakPolarHBondContact O-CB 3.46Å; V217-L221 PolarHBondContact O-N 3.35Å; V219-L221 PolarHBondContact O-N 3.16Å; L221-M223 VanDerWaalsContact C-N 3.35Å; L221-M223 PolarHBondContact O-N 3.35Å; L221-M224 HydrophobicContact CD1-CE 3.54Å; L221-M224 PolarHBondContact O-N 2.82Å; L221-N225 VanDerWaalsContact O-CG 3.29Å; L221-N225 PolarHBondContact O-N 3.17Å; L221-N225 PolarHBondContact O-ND2 3.05Å; L221-Q270 HydrophobicContact CD1-CB 4.46Å; L221-Q270 HydrophobicContact CD1-CG 4.37Å; L221-A273 HydrophobicContact CD1-CB 4.3Å; L221-A273 HydrophobicContact CD2-CB 4.05Å; L221-M277 HydrophobicContact CD2-CE 3.8Å |
| 222 | S | 98 | Very high | 96.6 | Very high | 69 Ų | 69 | 56.2 Ų | 56.2 | 48% | 0.483 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -61.6 | -43.8 | 178.3 | -58.7 | 0 | 0 | 0 | 0 | 111.5 | Q218 V219 N225 Q226 | Q218-S222 WeakPolarHBondContact O-CB 3.44Å; Q218-S222 PolarHBondContact O-N 3.36Å; Q218-S222 PolarHBondContact O-OG 3.26Å; V219-S222 PolarHBondContact O-N 3.05Å; S222-N225 PolarHBondContact O-N 3.12Å; S222-Q226 PolarHBondContact O-N 3.36Å; S222-Q226 VanDerWaalsContact O-N 3.08Å |
| 223 | M | 97.5 | Very high | 97 | Very high | 59 Ų | 59 | 56.4 Ų | 56.4 | 29% | 0.291 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65.3 | -42.4 | 175 | -177.7 | 173.8 | 52.2 | 0 | 0 | 111.8 | V219 L221 N225 Q226 K227 | V219-M223 WeakPolarHBondContact O-CB 3.47Å; V219-M223 PolarHBondContact O-N 2.95Å; L221-M223 VanDerWaalsContact C-N 3.35Å; L221-M223 PolarHBondContact O-N 3.35Å; M223-N225 VanDerWaalsContact C-N 3.33Å; M223-N225 PolarHBondContact O-N 3.3Å; M223-Q226 PolarHBondContact O-N 3.06Å; M223-K227 WeakPolarHBondContact O-CG 3.39Å; M223-K227 PolarHBondContact O-N 3.29Å |
| 224 | M | 97.6 | Very high | 97.1 | Very high | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 175.7 | -177.4 | -170.9 | 61.4 | 0 | 0 | 111 | F196 A199 L203 S220 L221 K227 G228 L269 | F196-M224 HydrophobicContact CE2-CG 4.02Å; A199-M224 HydrophobicContact CB-CB 4.39Å; L203-M224 HydrophobicContact CD2-CE 3.57Å; L203-M224 HydrophobicContact CD2-SD 3.63Å; S220-M224 WeakPolarHBondContact O-CB 3.4Å; S220-M224 PolarHBondContact O-N 2.87Å; L221-M224 HydrophobicContact CD1-CE 3.54Å; L221-M224 PolarHBondContact O-N 2.82Å; M224-K227 CarbonylContact O-C 3.54Å; M224-K227 PolarHBondContact O-N 3.31Å; M224-G228 PolarHBondContact O-N 3.21Å; M224-L269 HydrophobicContact CE-CB 4.22Å; M224-L269 HydrophobicContact SD-CB 4.04Å; M224-L269 HydrophobicContact SD-CD1 4.02Å |
| 225 | N | 97.8 | Very high | 97.2 | Very high | 41 Ų | 41 | 52.3 Ų | 52.3 | 22% | 0.219 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.3 | -46.9 | 178.3 | -70.8 | -18.2 | 0 | 0 | 0 | 111.4 | L221 S222 M223 K227 G228 D229 W266 | L221-N225 VanDerWaalsContact O-CG 3.29Å; L221-N225 PolarHBondContact O-N 3.17Å; L221-N225 PolarHBondContact O-ND2 3.05Å; S222-N225 PolarHBondContact O-N 3.12Å; M223-N225 VanDerWaalsContact C-N 3.33Å; M223-N225 PolarHBondContact O-N 3.3Å; N225-K227 VanDerWaalsContact C-N 3.27Å; N225-K227 PolarHBondContact O-N 2.86Å; N225-G228 WeakPolarHBondContact O-CA 3.42Å; N225-G228 PolarHBondContact O-N 3.48Å; N225-D229 PolarHBondContact O-N 3.4Å; N225-W266 PolarHBondContact OD1-NE1 3.49Å |
| 226 | Q | 98.1 | Very high | 97.3 | Very high | 128 Ų | 128 | 50.9 Ų | 50.9 | 60% | 0.598 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -57.1 | -40.9 | 175.5 | -170.4 | -170.5 | 23.2 | 0 | 0 | 112.3 | S222 M223 S230 | S222-Q226 PolarHBondContact O-N 3.36Å; S222-Q226 VanDerWaalsContact O-N 3.08Å; M223-Q226 PolarHBondContact O-N 3.06Å; Q226-S230 PolarHBondContact O-N 3.05Å |
| 227 | K | 98 | Very high | 97.3 | Very high | 81 Ų | 81 | 51.8 Ų | 51.8 | 35% | 0.352 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -72.9 | -32.1 | 176 | -62.2 | -55.6 | 178.2 | -170.6 | 0 | 112.4 | F196 A199 M223 M224 N225 S230 L231 | F196-K227 HydrophobicContact CD2-CB 4.48Å; A199-K227 HydrophobicContact CB-CG 4.48Å; M223-K227 WeakPolarHBondContact O-CG 3.39Å; M223-K227 PolarHBondContact O-N 3.29Å; M224-K227 CarbonylContact O-C 3.54Å; M224-K227 PolarHBondContact O-N 3.31Å; N225-K227 VanDerWaalsContact C-N 3.27Å; N225-K227 PolarHBondContact O-N 2.86Å; K227-S230 PolarHBondContact O-N 3.5Å; K227-L231 WeakPolarHBondContact O-CB 3.44Å; K227-L231 PolarHBondContact O-N 3.47Å |
| 228 | G | 97.5 | Very high | 97.3 | Very high | 8 Ų | 8 | 52.3 Ų | 52.3 | 8% | 0.082 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.2 | -46.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | M224 N225 S230 L231 A232 | M224-G228 PolarHBondContact O-N 3.21Å; N225-G228 WeakPolarHBondContact O-CA 3.42Å; N225-G228 PolarHBondContact O-N 3.48Å; G228-S230 PolarHBondContact O-N 2.77Å; G228-L231 PolarHBondContact O-N 3.46Å; G228-A232 WeakPolarHBondContact O-CB 3.28Å; G228-A232 PolarHBondContact O-N 3.26Å |
| 229 | D | 97.5 | Very high | 97.2 | Very high | 99 Ų | 99 | 49 Ų | 49 | 53% | 0.529 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.6 | -42.9 | 176.1 | -65 | -28.5 | 0 | 0 | 0 | 111.5 | N225 L231 A232 A233 | N225-D229 PolarHBondContact O-N 3.4Å; D229-L231 VanDerWaalsContact C-N 3.33Å; D229-L231 PolarHBondContact O-N 2.83Å; D229-A232 PolarHBondContact O-N 2.86Å; D229-A233 PolarHBondContact O-N 3.39Å |
| 230 | S | 96.9 | Very high | 97.1 | Very high | 60 Ų | 60 | 49 Ų | 49 | 42% | 0.42 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.7 | -39.1 | 174.5 | -177 | 0 | 0 | 0 | 0 | 112.2 | Q226 K227 G228 E234 | Q226-S230 PolarHBondContact O-N 3.05Å; K227-S230 PolarHBondContact O-N 3.5Å; G228-S230 PolarHBondContact O-N 2.77Å; S230-E234 WeakPolarHBondContact O-CG 3.49Å; S230-E234 PolarHBondContact O-N 2.95Å |
| 231 | L | 97.7 | Very high | 97 | Very high | 7 Ų | 7 | 50.5 Ų | 50.5 | 4% | 0.037 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -67.4 | -43.4 | 176.1 | 176.1 | 61.6 | 0 | 0 | 0 | 111.1 | A192 R193 F196 K227 G228 D229 A233 E234 E235 Y262 | A192-L231 HydrophobicContact CB-CD1 4Å; R193-L231 HydrophobicContact CB-CD1 4.42Å; R193-L231 HydrophobicContact CG-CD1 3.55Å; F196-L231 HydrophobicContact CB-CD2 3.93Å; F196-L231 HydrophobicContact CD1-CD2 3.79Å; F196-L231 HydrophobicContact CD2-CD2 4.43Å; F196-L231 HydrophobicContact CE1-CD2 4.45Å; F196-L231 HydrophobicContact CG-CD2 3.78Å; K227-L231 WeakPolarHBondContact O-CB 3.44Å; K227-L231 PolarHBondContact O-N 3.47Å; G228-L231 PolarHBondContact O-N 3.46Å; D229-L231 VanDerWaalsContact C-N 3.33Å; D229-L231 PolarHBondContact O-N 2.83Å; L231-A233 VanDerWaalsContact C-N 3.3Å; L231-A233 PolarHBondContact O-N 2.95Å; L231-E234 PolarHBondContact O-N 2.86Å; L231-E235 HydrophobicContact CD1-CG 3.93Å; L231-E235 HydrophobicContact CG-CG 4.16Å; L231-E235 WeakPolarHBondContact O-CB 3.45Å; L231-E235 VanDerWaalsContact O-CG 3.31Å; L231-E235 WeakPolarHBondContact O-CG 3.27Å; L231-E235 PolarHBondContact O-N 3.49Å; L231-Y262 HydrophobicContact CD2-CD1 4.11Å; L231-Y262 HydrophobicContact CD2-CG 4Å |
| 232 | A | 97.1 | Very high | 96.9 | Very high | 59 Ų | 59 | 50.2 Ų | 50.2 | 49% | 0.488 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59.7 | -41.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | G228 D229 Q236 | G228-A232 WeakPolarHBondContact O-CB 3.28Å; G228-A232 PolarHBondContact O-N 3.26Å; D229-A232 PolarHBondContact O-N 2.86Å; A232-Q236 WeakPolarHBondContact O-CB 3.33Å; A232-Q236 PolarHBondContact O-N 3.5Å |
| 233 | A | 97.1 | Very high | 96.7 | Very high | 46 Ų | 46 | 52.6 Ų | 52.6 | 38% | 0.38 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -62.7 | -42.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | D229 L231 K237 | D229-A233 PolarHBondContact O-N 3.39Å; L231-A233 VanDerWaalsContact C-N 3.3Å; L231-A233 PolarHBondContact O-N 2.95Å; A233-K237 WeakPolarHBondContact O-CG 3.34Å; A233-K237 PolarHBondContact O-N 2.9Å; A233-K237 VanDerWaalsContact O-N 3.12Å |
| 234 | E | 96.8 | Very high | 96.5 | Very high | 35 Ų | 35 | 56.2 Ų | 56.2 | 16% | 0.164 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -73.8 | -36 | 178.6 | -64.9 | -54.4 | 135.1 | 0 | 0 | 112.9 | A192 S230 L231 Q236 K237 F238 | A192-E234 HydrophobicContact CB-CB 4.49Å; A192-E234 HydrophobicContact CB-CG 4.33Å; S230-E234 WeakPolarHBondContact O-CG 3.49Å; S230-E234 PolarHBondContact O-N 2.95Å; L231-E234 PolarHBondContact O-N 2.86Å; E234-Q236 VanDerWaalsContact C-N 3.34Å; E234-K237 PolarHBondContact O-N 3.25Å; E234-K237 IonicContact OE1-NZ 3.92Å; E234-K237 PolarHBondContact OE1-NZ 3.45Å; E234-K237 IonicContact OE2-NZ 2.75Å; E234-F238 WeakPolarHBondContact O-CB 3.33Å; E234-F238 PolarHBondContact O-N 3.25Å |
| 235 | E | 96.9 | Very high | 96.2 | Very high | 9 Ų | 9 | 58.4 Ų | 58.4 | 4% | 0.042 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.3 | -42.4 | 172.6 | -73.1 | -71 | 166.9 | 0 | 0 | 111.1 | R189 R193 L231 F238 L239 A259 | R189-E235 IonicContact CZ-OE1 2.74Å; R189-E235 IonicContact CZ-OE2 3.68Å; R189-E235 IonicContact NE-OE1 3.16Å; R189-E235 PolarHBondContact NE-OE1 2.86Å; R189-E235 IonicContact NE-OE2 2.95Å; R189-E235 PolarHBondContact NE-OE2 3.19Å; R189-E235 IonicContact NH2-OE1 2.76Å; R189-E235 IonicContact NH2-OE2 3.58Å; R189-E235 PolarHBondContact NH2-OE2 3.46Å; R193-E235 IonicContact CZ-OE1 2.83Å; R193-E235 IonicContact NE-OE1 3.63Å; R193-E235 PolarHBondContact NE-OE1 3.21Å; R193-E235 IonicContact NH2-OE1 3.13Å; R193-E235 PolarHBondContact NH2-OE1 3.4Å; R193-E235 IonicContact NH2-OE2 2.73Å; L231-E235 HydrophobicContact CD1-CG 3.93Å; L231-E235 HydrophobicContact CG-CG 4.16Å; L231-E235 WeakPolarHBondContact O-CB 3.45Å; L231-E235 VanDerWaalsContact O-CG 3.31Å; L231-E235 WeakPolarHBondContact O-CG 3.27Å; L231-E235 PolarHBondContact O-N 3.49Å; E235-F238 PolarHBondContact O-N 3.01Å; E235-L239 WeakPolarHBondContact O-CG 3.48Å; E235-L239 PolarHBondContact O-N 3.22Å; E235-A259 HydrophobicContact CB-CB 4.35Å; E235-A259 HydrophobicContact CG-CB 4.25Å |
| 236 | Q | 96.4 | Very high | 95.8 | Very high | 86 Ų | 86 | 62.8 Ų | 62.8 | 40% | 0.402 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 176.8 | -178.9 | 59.5 | 29.5 | 0 | 0 | 111.6 | A232 E234 F238 L239 E240 | A232-Q236 WeakPolarHBondContact O-CB 3.33Å; A232-Q236 PolarHBondContact O-N 3.5Å; E234-Q236 VanDerWaalsContact C-N 3.34Å; Q236-F238 VanDerWaalsContact C-N 3.27Å; Q236-F238 PolarHBondContact O-N 2.89Å; Q236-L239 PolarHBondContact O-N 2.86Å; Q236-E240 WeakPolarHBondContact CG-OE1 3.21Å; Q236-E240 PolarHBondContact NE2-OE1 2.85Å; Q236-E240 WeakPolarHBondContact O-CG 3.12Å; Q236-E240 PolarHBondContact O-N 3.02Å |
| 237 | K | 96.3 | Very high | 95.5 | Very high | 94 Ų | 94 | 58.5 Ų | 58.5 | 41% | 0.409 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -58.1 | -40.2 | 174.7 | -70.7 | 171.3 | -169.7 | 171 | 0 | 112.1 | A233 E234 E240 V241 | A233-K237 WeakPolarHBondContact O-CG 3.34Å; A233-K237 PolarHBondContact O-N 2.9Å; A233-K237 VanDerWaalsContact O-N 3.12Å; E234-K237 PolarHBondContact O-N 3.25Å; E234-K237 IonicContact OE1-NZ 3.92Å; E234-K237 PolarHBondContact OE1-NZ 3.45Å; E234-K237 IonicContact OE2-NZ 2.75Å; K237-E240 PolarHBondContact O-N 2.83Å; K237-V241 WeakPolarHBondContact O-CG2 3.38Å; K237-V241 PolarHBondContact O-N 3.47Å |
| 238 | F | 96.7 | Very high | 95.3 | Very high | 12 Ų | 12 | 61 Ų | 61 | 5% | 0.053 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.7 | -43.9 | 177.9 | -179.3 | -100.4 | 0 | 0 | 0 | 112 | M182 I185 K186 R189 E234 E235 Q236 V241 L242 A255 | M182-F238 HydrophobicContact CE-CD2 4.15Å; M182-F238 HydrophobicContact CE-CE2 3.34Å; M182-F238 HydrophobicContact CE-CZ 3.77Å; M182-F238 HydrophobicContact SD-CD2 4.13Å; M182-F238 HydrophobicContact SD-CE2 3.78Å; I185-F238 HydrophobicContact CG2-CB 3.83Å; I185-F238 HydrophobicContact CG2-CD2 3.99Å; I185-F238 HydrophobicContact CG2-CG 4.43Å; K186-F238 HydrophobicContact CG-CD2 4.32Å; K186-F238 HydrophobicContact CG-CE2 3.64Å; R189-F238 VanDerWaalsContact CZ-CD1 3.43Å; R189-F238 VanDerWaalsContact NH1-CD1 3.28Å; E234-F238 WeakPolarHBondContact O-CB 3.33Å; E234-F238 PolarHBondContact O-N 3.25Å; E235-F238 PolarHBondContact O-N 3.01Å; Q236-F238 VanDerWaalsContact C-N 3.27Å; Q236-F238 PolarHBondContact O-N 2.89Å; F238-V241 PolarHBondContact O-N 3.34Å; F238-L242 HydrophobicContact CD1-CD1 3.9Å; F238-L242 HydrophobicContact CD1-CG 4.4Å; F238-L242 HydrophobicContact CE1-CD1 3.27Å; F238-L242 HydrophobicContact CE1-CG 3.93Å; F238-L242 HydrophobicContact CZ-CD1 3.76Å; F238-L242 HydrophobicContact CZ-CD2 4.32Å; F238-L242 HydrophobicContact CZ-CG 4.04Å; F238-L242 WeakPolarHBondContact O-CG 3.36Å; F238-L242 PolarHBondContact O-N 3.02Å; F238-A255 HydrophobicContact CE1-CB 3.94Å |
| 239 | L | 95.8 | Very high | 95.1 | Very high | 32 Ų | 32 | 66.5 Ų | 66.5 | 17% | 0.168 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -65.3 | -39 | 175.6 | -70.5 | 172.1 | 0 | 0 | 0 | 112 | E235 Q236 L242 L243 A255 A256 | E235-L239 WeakPolarHBondContact O-CG 3.48Å; E235-L239 PolarHBondContact O-N 3.22Å; Q236-L239 PolarHBondContact O-N 2.86Å; L239-L242 PolarHBondContact O-N 3.07Å; L239-L243 WeakPolarHBondContact O-CB 3.44Å; L239-L243 VanDerWaalsContact O-CG 3.28Å; L239-L243 WeakPolarHBondContact O-CG 3.36Å; L239-L243 PolarHBondContact O-N 2.99Å; L239-A255 HydrophobicContact CD2-CB 4.09Å; L239-A256 HydrophobicContact CD2-CB 4.34Å |
| 240 | E | 94.8 | Very high | 95 | Very high | 89 Ų | 89 | 64.5 Ų | 64.5 | 42% | 0.416 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -61.8 | -43.5 | 174.9 | -75.3 | 171 | -167.9 | 0 | 0 | 112 | Q236 K237 L243 N244 | Q236-E240 WeakPolarHBondContact CG-OE1 3.21Å; Q236-E240 PolarHBondContact NE2-OE1 2.85Å; Q236-E240 WeakPolarHBondContact O-CG 3.12Å; Q236-E240 PolarHBondContact O-N 3.02Å; K237-E240 PolarHBondContact O-N 2.83Å; E240-L243 PolarHBondContact O-N 3.36Å; E240-N244 WeakPolarHBondContact O-CB 3.35Å; E240-N244 VanDerWaalsContact O-CG 3.23Å; E240-N244 PolarHBondContact O-N 3.39Å; E240-N244 PolarHBondContact O-ND2 3.26Å |
| 241 | V | 95.2 | Very high | 94.9 | Very high | 32 Ų | 32 | 66.9 Ų | 66.9 | 19% | 0.194 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -67.1 | -38.4 | 176 | 171.3 | 0 | 0 | 0 | 0 | 111.8 | M182 I185 K237 F238 N244 S245 | M182-V241 HydrophobicContact CB-CG1 4.25Å; M182-V241 HydrophobicContact CG-CG1 4.47Å; M182-V241 HydrophobicContact SD-CB 4.49Å; M182-V241 HydrophobicContact SD-CG1 3.68Å; I185-V241 HydrophobicContact CD1-CB 4.14Å; I185-V241 HydrophobicContact CD1-CG1 4.46Å; I185-V241 HydrophobicContact CD1-CG2 3.36Å; K237-V241 WeakPolarHBondContact O-CG2 3.38Å; K237-V241 PolarHBondContact O-N 3.47Å; F238-V241 PolarHBondContact O-N 3.34Å; V241-N244 PolarHBondContact O-N 2.97Å; V241-S245 WeakPolarHBondContact O-CB 3.43Å; V241-S245 PolarHBondContact O-N 3.37Å; V241-S245 PolarHBondContact O-OG 3.26Å |
| 242 | L | 94.8 | Very high | 94.8 | Very high | 8 Ų | 8 | 67.8 Ų | 67.8 | 4% | 0.042 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -60.2 | -46.4 | 172.6 | -78.9 | -180 | 0 | 0 | 0 | 112 | M182 F238 L239 N244 S245 T247 I252 A255 | M182-L242 HydrophobicContact CE-CD2 3.34Å; M182-L242 HydrophobicContact CE-CG 3.9Å; F238-L242 HydrophobicContact CD1-CD1 3.9Å; F238-L242 HydrophobicContact CD1-CG 4.4Å; F238-L242 HydrophobicContact CE1-CD1 3.27Å; F238-L242 HydrophobicContact CE1-CG 3.93Å; F238-L242 HydrophobicContact CZ-CD1 3.76Å; F238-L242 HydrophobicContact CZ-CD2 4.32Å; F238-L242 HydrophobicContact CZ-CG 4.04Å; F238-L242 WeakPolarHBondContact O-CG 3.36Å; F238-L242 PolarHBondContact O-N 3.02Å; L239-L242 PolarHBondContact O-N 3.07Å; L242-N244 VanDerWaalsContact C-N 3.28Å; L242-N244 PolarHBondContact O-N 3.25Å; L242-S245 WeakPolarHBondContact CA-OG 3.34Å; L242-S245 CarbonylContact O-C 3.58Å; L242-S245 PolarHBondContact O-N 3.26Å; L242-S245 VanDerWaalsContact O-N 3.1Å; L242-S245 PolarHBondContact O-OG 3.36Å; L242-T247 HydrophobicContact CD2-CG2 3.76Å; L242-T247 PolarHBondContact O-OG1 3.5Å; L242-I252 HydrophobicContact CB-CG1 4.25Å; L242-A255 HydrophobicContact CD1-CB 3.7Å |
| 243 | L | 93.9 | Very high | 94.8 | Very high | 119 Ų | 119 | 69.4 Ų | 69.4 | 62% | 0.623 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -64.3 | -31.9 | 178.6 | -72.6 | 167.8 | 0 | 0 | 0 | 113.2 | L239 E240 I252 | L239-L243 WeakPolarHBondContact O-CB 3.44Å; L239-L243 VanDerWaalsContact O-CG 3.28Å; L239-L243 WeakPolarHBondContact O-CG 3.36Å; L239-L243 PolarHBondContact O-N 2.99Å; E240-L243 PolarHBondContact O-N 3.36Å; L243-I252 HydrophobicContact CD2-CD1 4.08Å; L243-I252 HydrophobicContact CD2-CG2 4.3Å |
| 244 | N | 92.8 | Very high | 94.8 | Very high | 136 Ų | 136 | 74.8 Ų | 74.8 | 73% | 0.727 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -81.3 | -18.7 | 175.6 | -69 | -38.7 | 0 | 0 | 0 | 112.8 | E240 V241 L242 | E240-N244 WeakPolarHBondContact O-CB 3.35Å; E240-N244 VanDerWaalsContact O-CG 3.23Å; E240-N244 PolarHBondContact O-N 3.39Å; E240-N244 PolarHBondContact O-ND2 3.26Å; V241-N244 PolarHBondContact O-N 2.97Å; L242-N244 VanDerWaalsContact C-N 3.28Å; L242-N244 PolarHBondContact O-N 3.25Å |
| 245 | S | 91.1 | Very high | 94.7 | Very high | 45 Ų | 45 | 73.7 Ų | 73.7 | 32% | 0.315 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | 154.1 | 173.1 | 72.1 | 0 | 0 | 0 | 0 | 110.8 | V241 L242 T247 | V241-S245 WeakPolarHBondContact O-CB 3.43Å; V241-S245 PolarHBondContact O-N 3.37Å; V241-S245 PolarHBondContact O-OG 3.26Å; L242-S245 WeakPolarHBondContact CA-OG 3.34Å; L242-S245 CarbonylContact O-C 3.58Å; L242-S245 PolarHBondContact O-N 3.26Å; L242-S245 VanDerWaalsContact O-N 3.1Å; L242-S245 PolarHBondContact O-OG 3.36Å; S245-T247 PolarHBondContact O-N 2.99Å; S245-T247 VanDerWaalsContact OG-CG2 3.23Å; S245-T247 WeakPolarHBondContact OG-CG2 3.14Å; S245-T247 PolarHBondContact OG-OG1 3.05Å; S245-T247 VanDerWaalsContact OG-OG1 3.1Å |
| 246 | S | 90.5 | Very high | 94.7 | Very high | 133 Ų | 133 | 74.8 Ų | 74.8 | 93% | 0.93 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77 | 35.5 | 176.5 | 62.4 | 0 | 0 | 0 | 0 | 112.8 | ||
| 247 | T | 91.2 | Very high | 94.7 | Very high | 39 Ų | 39 | 76.7 Ų | 76.7 | 24% | 0.239 | 41% | 0.411 | C | S | . | . | trans | -70.3 | 150.5 | 178.5 | 45 | 0 | 0 | 0 | 0 | 111.4 | L242 S245 | L242-T247 HydrophobicContact CD2-CG2 3.76Å; L242-T247 PolarHBondContact O-OG1 3.5Å; S245-T247 PolarHBondContact O-N 2.99Å; S245-T247 VanDerWaalsContact OG-CG2 3.23Å; S245-T247 WeakPolarHBondContact OG-CG2 3.14Å; S245-T247 PolarHBondContact OG-OG1 3.05Å; S245-T247 VanDerWaalsContact OG-OG1 3.1Å | ||
| 248 | E | 94.4 | Very high | 94.6 | Very high | 133 Ų | 133 | 73.1 Ų | 73.1 | 62% | 0.621 | 40% | 0.401 | S | S | * | . | trans | -65.6 | 139.9 | 179.9 | -170.9 | 178.5 | 176.8 | 0 | 0 | 111 | A250 E251 I252 | E248-A250 HydrophobicContact CG-CB 4.23Å; E248-A250 PolarHBondContact O-N 3.39Å; E248-A250 VanDerWaalsContact O-N 3.17Å; E248-E251 HydrophobicContact CB-CG 4.34Å; E248-E251 WeakPolarHBondContact O-CB 3.27Å; E248-E251 PolarHBondContact O-N 3.1Å; E248-I252 PolarHBondContact O-N 2.85Å | ||
| 249 | I | 93.6 | Very high | 94.6 | Very high | 124 Ų | 124 | 73.4 Ų | 73.4 | 64% | 0.636 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -55.7 | -37 | -179.2 | -61.6 | 169.3 | 0 | 0 | 0 | 111.2 | E251 I252 D253 | I249-E251 VanDerWaalsContact C-N 3.27Å; I249-E251 PolarHBondContact O-N 3.36Å; I249-I252 WeakPolarHBondContact O-CB 3.37Å; I249-I252 PolarHBondContact O-N 3.43Å; I249-I252 VanDerWaalsContact O-N 3.12Å; I249-D253 PolarHBondContact O-N 2.83Å |
| 250 | A | 95.7 | Very high | 94.6 | Very high | 57 Ų | 57 | 76 Ų | 76 | 47% | 0.471 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60.9 | -34 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | E248 K254 | E248-A250 HydrophobicContact CG-CB 4.23Å; E248-A250 PolarHBondContact O-N 3.39Å; E248-A250 VanDerWaalsContact O-N 3.17Å; A250-K254 WeakPolarHBondContact O-CB 3.47Å; A250-K254 PolarHBondContact O-N 3.12Å; A250-K254 VanDerWaalsContact O-N 3.12Å |
| 251 | E | 94.9 | Very high | 94.7 | Very high | 109 Ų | 109 | 77.7 Ų | 77.7 | 51% | 0.509 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -72.3 | -37 | 175.3 | -63.9 | -172.6 | 158.6 | 0 | 0 | 111.7 | E248 I249 K254 A255 | E248-E251 HydrophobicContact CB-CG 4.34Å; E248-E251 WeakPolarHBondContact O-CB 3.27Å; E248-E251 PolarHBondContact O-N 3.1Å; I249-E251 VanDerWaalsContact C-N 3.27Å; I249-E251 PolarHBondContact O-N 3.36Å; E251-K254 PolarHBondContact O-N 3.29Å; E251-A255 WeakPolarHBondContact O-CB 3.45Å; E251-A255 PolarHBondContact O-N 2.91Å |
| 252 | I | 95.4 | Very high | 94.7 | Very high | 27 Ų | 27 | 79 Ų | 79 | 14% | 0.138 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -64.4 | -46.1 | 175.8 | -56.3 | -179 | 0 | 0 | 0 | 110.1 | L242 L243 E248 I249 K254 A255 A256 | L242-I252 HydrophobicContact CB-CG1 4.25Å; L243-I252 HydrophobicContact CD2-CD1 4.08Å; L243-I252 HydrophobicContact CD2-CG2 4.3Å; E248-I252 PolarHBondContact O-N 2.85Å; I249-I252 WeakPolarHBondContact O-CB 3.37Å; I249-I252 PolarHBondContact O-N 3.43Å; I249-I252 VanDerWaalsContact O-N 3.12Å; I252-K254 PolarHBondContact O-N 2.93Å; I252-A255 WeakPolarHBondContact O-CB 3.43Å; I252-A255 PolarHBondContact O-N 3.49Å; I252-A256 WeakPolarHBondContact O-CB 3.32Å; I252-A256 PolarHBondContact O-N 3.27Å |
| 253 | D | 97 | Very high | 94.8 | Very high | 93 Ų | 93 | 82 Ų | 82 | 50% | 0.497 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.1 | -46.3 | 178 | -75.1 | -21.6 | 0 | 0 | 0 | 111 | I249 A255 A256 E257 | I249-D253 PolarHBondContact O-N 2.83Å; D253-A255 VanDerWaalsContact C-N 3.3Å; D253-A255 PolarHBondContact O-N 2.78Å; D253-A256 PolarHBondContact O-N 3.36Å; D253-A256 VanDerWaalsContact O-N 3.16Å; D253-E257 WeakPolarHBondContact O-CG 3.36Å; D253-E257 PolarHBondContact O-N 2.91Å |
| 254 | K | 96.4 | Very high | 94.9 | Very high | 158 Ų | 158 | 84.2 Ų | 84.2 | 69% | 0.687 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -61.4 | -37.9 | 175.6 | -173.2 | 177.9 | -178.8 | 179.3 | 0 | 112.4 | A250 E251 I252 G258 | A250-K254 WeakPolarHBondContact O-CB 3.47Å; A250-K254 PolarHBondContact O-N 3.12Å; A250-K254 VanDerWaalsContact O-N 3.12Å; E251-K254 PolarHBondContact O-N 3.29Å; I252-K254 PolarHBondContact O-N 2.93Å; K254-G258 PolarHBondContact O-N 2.93Å; K254-G258 VanDerWaalsContact O-N 3.13Å |
| 255 | A | 94.4 | Very high | 95.1 | Very high | 13 Ų | 13 | 82 Ų | 82 | 11% | 0.107 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -66.6 | -39.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | R189 F238 L239 L242 E251 I252 D253 G258 A259 | R189-A255 PolarHBondContact NH2-O 3.17Å; F238-A255 HydrophobicContact CE1-CB 3.94Å; L239-A255 HydrophobicContact CD2-CB 4.09Å; L242-A255 HydrophobicContact CD1-CB 3.7Å; E251-A255 WeakPolarHBondContact O-CB 3.45Å; E251-A255 PolarHBondContact O-N 2.91Å; I252-A255 WeakPolarHBondContact O-CB 3.43Å; I252-A255 PolarHBondContact O-N 3.49Å; D253-A255 VanDerWaalsContact C-N 3.3Å; D253-A255 PolarHBondContact O-N 2.78Å; A255-G258 PolarHBondContact O-N 3.3Å; A255-A259 PolarHBondContact O-N 3.4Å; A255-A259 VanDerWaalsContact O-N 3.16Å |
| 256 | A | 96.4 | Very high | 95.4 | Very high | 32 Ų | 32 | 82.9 Ų | 82.9 | 26% | 0.264 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -67.4 | -44.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L239 I252 D253 G258 A259 E260 | L239-A256 HydrophobicContact CD2-CB 4.34Å; I252-A256 WeakPolarHBondContact O-CB 3.32Å; I252-A256 PolarHBondContact O-N 3.27Å; D253-A256 PolarHBondContact O-N 3.36Å; D253-A256 VanDerWaalsContact O-N 3.16Å; A256-G258 VanDerWaalsContact C-N 3.28Å; A256-G258 PolarHBondContact O-N 3.43Å; A256-A259 WeakPolarHBondContact O-CB 3.47Å; A256-A259 PolarHBondContact O-N 3.07Å; A256-E260 PolarHBondContact O-N 2.93Å |
| 257 | E | 96.9 | Very high | 95.8 | Very high | 125 Ų | 125 | 80.1 Ų | 80.1 | 58% | 0.584 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -57.2 | -42.5 | 174.5 | -74.4 | 179.3 | 175.4 | 0 | 0 | 111.8 | D253 A259 E260 E261 | D253-E257 WeakPolarHBondContact O-CG 3.36Å; D253-E257 PolarHBondContact O-N 2.91Å; E257-A259 VanDerWaalsContact C-N 3.32Å; E257-A259 PolarHBondContact O-N 2.91Å; E257-E260 PolarHBondContact O-N 3.04Å; E257-E261 PolarHBondContact O-N 3.18Å |
| 258 | G | 94.5 | Very high | 96.1 | Very high | 20 Ų | 20 | 85.8 Ų | 85.8 | 21% | 0.206 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -62.3 | -37.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | K254 A255 A256 E261 Y262 | K254-G258 PolarHBondContact O-N 2.93Å; K254-G258 VanDerWaalsContact O-N 3.13Å; A255-G258 PolarHBondContact O-N 3.3Å; A256-G258 VanDerWaalsContact C-N 3.28Å; A256-G258 PolarHBondContact O-N 3.43Å; G258-E261 PolarHBondContact O-N 3.11Å; G258-Y262 WeakPolarHBondContact O-CD2 3.43Å |
| 259 | A | 95.8 | Very high | 96.2 | Very high | 17 Ų | 17 | 80.1 Ų | 80.1 | 14% | 0.14 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -67.5 | -41.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | E235 A255 A256 E257 E261 Y262 T263 | E235-A259 HydrophobicContact CB-CB 4.35Å; E235-A259 HydrophobicContact CG-CB 4.25Å; A255-A259 PolarHBondContact O-N 3.4Å; A255-A259 VanDerWaalsContact O-N 3.16Å; A256-A259 WeakPolarHBondContact O-CB 3.47Å; A256-A259 PolarHBondContact O-N 3.07Å; E257-A259 VanDerWaalsContact C-N 3.32Å; E257-A259 PolarHBondContact O-N 2.91Å; A259-E261 VanDerWaalsContact C-N 3.27Å; A259-E261 PolarHBondContact O-N 3.4Å; A259-Y262 PolarHBondContact O-N 3.01Å; A259-T263 PolarHBondContact O-N 3.5Å; A259-T263 PolarHBondContact O-OG1 3.38Å |
| 260 | E | 96.3 | Very high | 96.4 | Very high | 87 Ų | 87 | 76.4 Ų | 76.4 | 41% | 0.407 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63 | -31.5 | 177 | -69.6 | -170.2 | 157.9 | 0 | 0 | 112.9 | R67 A256 E257 T263 R264 | R67-E260 IonicContact CZ-OE1 3.36Å; R67-E260 IonicContact NH1-OE1 2.78Å; R67-E260 PolarHBondContact NH1-OE1 3.15Å; A256-E260 PolarHBondContact O-N 2.93Å; E257-E260 PolarHBondContact O-N 3.04Å; E260-T263 PolarHBondContact O-N 2.96Å; E260-R264 WeakPolarHBondContact O-CG 3.29Å; E260-R264 PolarHBondContact O-N 3.14Å |
| 261 | E | 96.6 | Very high | 96.5 | Very high | 124 Ų | 124 | 79.6 Ų | 79.6 | 58% | 0.579 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -61.6 | -43 | 175 | -170.7 | 172.3 | -174.6 | 0 | 0 | 112.6 | E257 G258 A259 R264 R265 | E257-E261 PolarHBondContact O-N 3.18Å; G258-E261 PolarHBondContact O-N 3.11Å; A259-E261 VanDerWaalsContact C-N 3.27Å; A259-E261 PolarHBondContact O-N 3.4Å; E261-R264 PolarHBondContact O-N 3.38Å; E261-R265 PolarHBondContact O-N 3.04Å |
| 262 | Y | 95.8 | Very high | 96.6 | Very high | 61 Ų | 61 | 76.5 Ų | 76.5 | 24% | 0.239 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -65.7 | -40.1 | 176 | -70.2 | -78.3 | 0 | 0 | 0 | 111.9 | R193 F196 L231 G258 A259 R264 R265 W266 | R193-Y262 HydrophobicContact CG-CE2 4.26Å; F196-Y262 AromaticContact CD1-CD1 3.82Å; F196-Y262 HydrophobicContact CD1-CD1 3.82Å; F196-Y262 HydrophobicContact CD1-CE1 4.48Å; F196-Y262 AromaticContact CE1-CD1 3.89Å; F196-Y262 HydrophobicContact CE1-CD1 3.89Å; L231-Y262 HydrophobicContact CD2-CD1 4.11Å; L231-Y262 HydrophobicContact CD2-CG 4Å; G258-Y262 WeakPolarHBondContact O-CD2 3.43Å; A259-Y262 PolarHBondContact O-N 3.01Å; Y262-R264 VanDerWaalsContact C-N 3.34Å; Y262-R264 PolarHBondContact O-N 3.37Å; Y262-R265 PolarHBondContact O-N 3.42Å; Y262-W266 WeakPolarHBondContact O-CB 3.44Å; Y262-W266 PolarHBondContact O-N 3.31Å |
| 263 | T | 96.4 | Very high | 96.7 | Very high | 70 Ų | 70 | 75.2 Ų | 75.2 | 43% | 0.429 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 175.5 | -55.1 | 0 | 0 | 0 | 0 | 111.6 | A259 E260 W266 L267 | A259-T263 PolarHBondContact O-N 3.5Å; A259-T263 PolarHBondContact O-OG1 3.38Å; E260-T263 PolarHBondContact O-N 2.96Å; T263-W266 HydrophobicContact CG2-CE3 4.49Å; T263-W266 PolarHBondContact O-N 2.8Å; T263-L267 HydrophobicContact CG2-CD1 4.21Å; T263-L267 WeakPolarHBondContact O-CG 3.4Å; T263-L267 PolarHBondContact O-N 3.03Å |
| 264 | R | 97.3 | Very high | 96.6 | Very high | 165 Ų | 165 | 73.9 Ų | 73.9 | 62% | 0.623 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -62.2 | -44 | 175.3 | -75.4 | -175.2 | -70.4 | 179 | -1.5 | 111.9 | E260 E261 Y262 K268 | E260-R264 WeakPolarHBondContact O-CG 3.29Å; E260-R264 PolarHBondContact O-N 3.14Å; E261-R264 PolarHBondContact O-N 3.38Å; Y262-R264 VanDerWaalsContact C-N 3.34Å; Y262-R264 PolarHBondContact O-N 3.37Å; R264-K268 WeakPolarHBondContact O-CB 3.3Å; R264-K268 PolarHBondContact O-N 3.42Å; R264-K268 VanDerWaalsContact O-N 3.07Å |
| 265 | R | 96.6 | Very high | 96.6 | Very high | 91 Ų | 91 | 69.3 Ų | 69.3 | 34% | 0.343 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 177.3 | -173.4 | 175.7 | -176.4 | 169.4 | 1.6 | 111.8 | E204 E261 Y262 K268 L269 | E204-R265 IonicContact OE1-CZ 2.7Å; E204-R265 IonicContact OE1-NE 3.5Å; E204-R265 PolarHBondContact OE1-NE 3.36Å; E204-R265 IonicContact OE1-NH2 3.95Å; E204-R265 PolarHBondContact OE1-NH2 3.15Å; E204-R265 IonicContact OE2-NH2 2.82Å; E204-R265 PolarHBondContact OE2-NH2 3.35Å; E204-R265 VanDerWaalsContact OE2-NH2 3.12Å; E261-R265 PolarHBondContact O-N 3.04Å; Y262-R265 PolarHBondContact O-N 3.42Å; R265-K268 PolarHBondContact O-N 2.93Å; R265-L269 HydrophobicContact CG-CD1 4.32Å; R265-L269 PolarHBondContact O-N 3.31Å; R265-L269 VanDerWaalsContact O-N 3.11Å |
| 266 | W | 97.6 | Very high | 96.5 | Very high | 63 Ų | 63 | 70 Ų | 70 | 24% | 0.239 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -57 | -53.5 | 176.7 | 176.1 | 40.8 | 0 | 0 | 0 | 111.6 | F196 N225 Y262 T263 K268 L269 Q270 | F196-W266 HydrophobicContact CE2-CB 4.31Å; F196-W266 HydrophobicContact CE2-CG 4.43Å; F196-W266 HydrophobicContact CZ-CB 3.81Å; F196-W266 HydrophobicContact CZ-CG 4.4Å; N225-W266 PolarHBondContact OD1-NE1 3.49Å; Y262-W266 WeakPolarHBondContact O-CB 3.44Å; Y262-W266 PolarHBondContact O-N 3.31Å; T263-W266 HydrophobicContact CG2-CE3 4.49Å; T263-W266 PolarHBondContact O-N 2.8Å; W266-K268 VanDerWaalsContact C-N 3.32Å; W266-K268 PolarHBondContact O-N 3.3Å; W266-L269 PolarHBondContact O-N 3.38Å; W266-Q270 WeakPolarHBondContact O-CB 3.45Å; W266-Q270 PolarHBondContact O-N 3.31Å |
| 267 | L | 97.9 | Very high | 96.3 | Very high | 75 Ų | 75 | 70 Ų | 70 | 39% | 0.393 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -61.3 | -39.4 | -179.6 | -70.8 | 172.6 | 0 | 0 | 0 | 112.5 | T263 Q270 Q271 | T263-L267 HydrophobicContact CG2-CD1 4.21Å; T263-L267 WeakPolarHBondContact O-CG 3.4Å; T263-L267 PolarHBondContact O-N 3.03Å; L267-Q270 PolarHBondContact O-N 3.31Å; L267-Q271 WeakPolarHBondContact O-CB 3.49Å; L267-Q271 VanDerWaalsContact O-CG 3.29Å; L267-Q271 WeakPolarHBondContact O-CG 3.39Å; L267-Q271 PolarHBondContact O-N 2.98Å |
| 268 | K | 98 | Very high | 96 | Very high | 157 Ų | 157 | 70.6 Ų | 70.6 | 68% | 0.683 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -61.4 | -45.9 | 177 | -175.9 | -178.6 | 178.2 | -176.3 | 0 | 111.6 | R264 R265 W266 Q271 A272 | R264-K268 WeakPolarHBondContact O-CB 3.3Å; R264-K268 PolarHBondContact O-N 3.42Å; R264-K268 VanDerWaalsContact O-N 3.07Å; R265-K268 PolarHBondContact O-N 2.93Å; W266-K268 VanDerWaalsContact C-N 3.32Å; W266-K268 PolarHBondContact O-N 3.3Å; K268-Q271 PolarHBondContact O-N 3.29Å; K268-A272 WeakPolarHBondContact O-CB 3.3Å; K268-A272 PolarHBondContact O-N 3.05Å |
| 269 | L | 97.1 | Very high | 95.8 | Very high | 14 Ų | 14 | 75.3 Ų | 75.3 | 7% | 0.073 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -69.3 | -39.1 | 178.9 | -71.9 | 175 | 0 | 0 | 0 | 112.2 | C200 L203 E204 M224 R265 W266 A272 A273 | C200-L269 HydrophobicContact CB-CD1 3.65Å; L203-L269 HydrophobicContact CD2-CB 4.15Å; E204-L269 HydrophobicContact CG-CD1 4.24Å; E204-L269 HydrophobicContact CG-CD2 3.47Å; E204-L269 VanDerWaalsContact CG-CD2 3.47Å; M224-L269 HydrophobicContact CE-CB 4.22Å; M224-L269 HydrophobicContact SD-CB 4.04Å; M224-L269 HydrophobicContact SD-CD1 4.02Å; R265-L269 HydrophobicContact CG-CD1 4.32Å; R265-L269 PolarHBondContact O-N 3.31Å; R265-L269 VanDerWaalsContact O-N 3.11Å; W266-L269 PolarHBondContact O-N 3.38Å; L269-A272 PolarHBondContact O-N 3.27Å; L269-A273 WeakPolarHBondContact O-CB 3.26Å; L269-A273 PolarHBondContact O-N 3.09Å |
| 270 | Q | 97.4 | Very high | 95.3 | Very high | 46 Ų | 46 | 76.6 Ų | 76.6 | 22% | 0.215 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -58.9 | -49 | 174 | -179.6 | 178.3 | 0.3 | 0 | 0 | 111.1 | L221 W266 L267 A272 A273 E274 | L221-Q270 HydrophobicContact CD1-CB 4.46Å; L221-Q270 HydrophobicContact CD1-CG 4.37Å; W266-Q270 WeakPolarHBondContact O-CB 3.45Å; W266-Q270 PolarHBondContact O-N 3.31Å; L267-Q270 PolarHBondContact O-N 3.31Å; Q270-A272 VanDerWaalsContact C-N 3.32Å; Q270-A272 PolarHBondContact O-N 3.41Å; Q270-A273 PolarHBondContact O-N 2.71Å; Q270-E274 WeakPolarHBondContact CG-OE1 3.29Å; Q270-E274 PolarHBondContact NE2-OE1 3.45Å; Q270-E274 WeakPolarHBondContact O-CB 3.02Å; Q270-E274 WeakPolarHBondContact O-CG 3.5Å; Q270-E274 PolarHBondContact O-N 3.1Å |
| 271 | Q | 97.9 | Very high | 94.7 | Very high | 124 Ų | 124 | 80 Ų | 80 | 58% | 0.579 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -62 | -38.5 | 177.5 | -73.7 | 175.6 | -0.9 | 0 | 0 | 112.5 | L267 K268 S275 | L267-Q271 WeakPolarHBondContact O-CB 3.49Å; L267-Q271 VanDerWaalsContact O-CG 3.29Å; L267-Q271 WeakPolarHBondContact O-CG 3.39Å; L267-Q271 PolarHBondContact O-N 2.98Å; K268-Q271 PolarHBondContact O-N 3.29Å; Q271-S275 VanDerWaalsContact O-CB 3.32Å; Q271-S275 WeakPolarHBondContact O-CB 3.23Å; Q271-S275 PolarHBondContact O-N 3.21Å; Q271-S275 PolarHBondContact O-OG 2.94Å |
| 272 | A | 96.9 | Very high | 94.1 | Very high | 45 Ų | 45 | 76 Ų | 76 | 37% | 0.372 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -64.3 | -46.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L207 K268 L269 Q270 S275 C276 | L207-A272 HydrophobicContact CD1-CB 4.15Å; K268-A272 WeakPolarHBondContact O-CB 3.3Å; K268-A272 PolarHBondContact O-N 3.05Å; L269-A272 PolarHBondContact O-N 3.27Å; Q270-A272 VanDerWaalsContact C-N 3.32Å; Q270-A272 PolarHBondContact O-N 3.41Å; A272-S275 PolarHBondContact O-N 3.38Å; A272-C276 PolarHBondContact O-N 3.32Å |
| 273 | A | 96.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 78 Ų | 78 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.3 | -44.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | L203 L207 V217 L221 L269 Q270 S275 C276 M277 | L203-A273 HydrophobicContact CD1-CB 4.46Å; L207-A273 HydrophobicContact CD1-CB 4.44Å; L207-A273 HydrophobicContact CD2-CB 4.39Å; V217-A273 HydrophobicContact CG1-CB 4.07Å; L221-A273 HydrophobicContact CD1-CB 4.3Å; L221-A273 HydrophobicContact CD2-CB 4.05Å; L269-A273 WeakPolarHBondContact O-CB 3.26Å; L269-A273 PolarHBondContact O-N 3.09Å; Q270-A273 PolarHBondContact O-N 2.71Å; A273-S275 VanDerWaalsContact C-N 3.31Å; A273-S275 PolarHBondContact O-N 3.3Å; A273-C276 WeakPolarHBondContact O-CB 3.32Å; A273-C276 PolarHBondContact O-N 3.19Å; A273-M277 WeakPolarHBondContact O-CG 3.44Å; A273-M277 PolarHBondContact O-N 3.47Å |
| 274 | E | 96.1 | Very high | 92.4 | Very high | 65 Ų | 65 | 80.4 Ų | 80.4 | 30% | 0.304 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -62.6 | -37.3 | 175.7 | -73.3 | 177.2 | -163.7 | 0 | 0 | 112.7 | Q270 M277 K278 | Q270-E274 WeakPolarHBondContact CG-OE1 3.29Å; Q270-E274 PolarHBondContact NE2-OE1 3.45Å; Q270-E274 WeakPolarHBondContact O-CB 3.02Å; Q270-E274 WeakPolarHBondContact O-CG 3.5Å; Q270-E274 PolarHBondContact O-N 3.1Å; E274-M277 HydrophobicContact CG-CE 4.29Å; E274-K278 WeakPolarHBondContact O-CB 3.47Å; E274-K278 VanDerWaalsContact O-CG 3.23Å; E274-K278 WeakPolarHBondContact O-CG 3.39Å; E274-K278 PolarHBondContact O-N 3.47Å |
| 275 | S | 95.3 | Very high | 91.3 | Very high | 61 Ų | 61 | 80.3 Ų | 80.3 | 43% | 0.427 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -67.6 | -42.1 | 177 | -59.2 | 0 | 0 | 0 | 0 | 111.4 | Q271 A272 A273 K278 I279 | Q271-S275 VanDerWaalsContact O-CB 3.32Å; Q271-S275 WeakPolarHBondContact O-CB 3.23Å; Q271-S275 PolarHBondContact O-N 3.21Å; Q271-S275 PolarHBondContact O-OG 2.94Å; A272-S275 PolarHBondContact O-N 3.38Å; A273-S275 VanDerWaalsContact C-N 3.31Å; A273-S275 PolarHBondContact O-N 3.3Å; S275-K278 PolarHBondContact O-N 3.47Å; S275-I279 VanDerWaalsContact O-CG1 3.29Å; S275-I279 WeakPolarHBondContact O-CG1 3.44Å; S275-I279 PolarHBondContact O-N 3.48Å; S275-I279 VanDerWaalsContact O-N 3.09Å |
| 276 | C | 93 | Very high | 89.9 | Confident | 28 Ų | 28 | 80.3 Ų | 80.3 | 19% | 0.189 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -58.4 | -49.3 | 175 | -174.8 | 0 | 0 | 0 | 0 | 111.5 | L207 A272 A273 K278 I279 D280 | L207-C276 HydrophobicContact CD2-CB 4.04Å; A272-C276 PolarHBondContact O-N 3.32Å; A273-C276 WeakPolarHBondContact O-CB 3.32Å; A273-C276 PolarHBondContact O-N 3.19Å; C276-K278 VanDerWaalsContact C-N 3.34Å; C276-K278 PolarHBondContact O-N 3.46Å; C276-I279 PolarHBondContact O-N 3.17Å; C276-D280 PolarHBondContact O-N 3.16Å |
| 277 | M | 91.7 | Very high | 88.1 | Confident | 33 Ų | 33 | 86.6 Ų | 86.6 | 16% | 0.163 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -64.9 | -33.6 | 178.4 | -67.3 | -175.7 | -69.5 | 0 | 0 | 113.5 | Q218 L221 A273 E274 R281 | Q218-M277 HydrophobicContact CB-SD 4.49Å; L221-M277 HydrophobicContact CD2-CE 3.8Å; A273-M277 WeakPolarHBondContact O-CG 3.44Å; A273-M277 PolarHBondContact O-N 3.47Å; E274-M277 HydrophobicContact CG-CE 4.29Å; M277-R281 WeakPolarHBondContact O-CG 3Å; M277-R281 PolarHBondContact O-N 3.44Å |
| 278 | K | 92.1 | Very high | 86.3 | Confident | 137 Ų | 137 | 88 Ų | 88 | 60% | 0.596 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -69 | -39.6 | 177.2 | -77.6 | 170.2 | -174.7 | 170 | 0 | 112.2 | E274 S275 C276 G282 | E274-K278 WeakPolarHBondContact O-CB 3.47Å; E274-K278 VanDerWaalsContact O-CG 3.23Å; E274-K278 WeakPolarHBondContact O-CG 3.39Å; E274-K278 PolarHBondContact O-N 3.47Å; S275-K278 PolarHBondContact O-N 3.47Å; C276-K278 VanDerWaalsContact C-N 3.34Å; C276-K278 PolarHBondContact O-N 3.46Å; K278-G282 PolarHBondContact O-N 2.98Å; K278-G282 VanDerWaalsContact O-N 3.1Å |
| 279 | I | 89.2 | Confident | 84.5 | Confident | 118 Ų | 118 | 85 Ų | 85 | 61% | 0.605 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64.4 | -45.6 | 179.7 | -68.4 | 164.5 | 0 | 0 | 0 | 110.1 | S275 C276 R281 G282 Q283 | S275-I279 VanDerWaalsContact O-CG1 3.29Å; S275-I279 WeakPolarHBondContact O-CG1 3.44Å; S275-I279 PolarHBondContact O-N 3.48Å; S275-I279 VanDerWaalsContact O-N 3.09Å; C276-I279 PolarHBondContact O-N 3.17Å; I279-R281 PolarHBondContact O-N 2.94Å; I279-G282 PolarHBondContact O-N 3.07Å; I279-Q283 PolarHBondContact O-N 3.13Å |
| 280 | D | 85.3 | Confident | 82.7 | Confident | 44 Ų | 44 | 87.3 Ų | 87.3 | 24% | 0.235 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -62.2 | -45.7 | 179.7 | -175.1 | 76.1 | 0 | 0 | 0 | 112.2 | L214 C276 G282 Q283 Q284 | L214-D280 HydrophobicContact CD1-CB 3.72Å; L214-D280 WeakPolarHBondContact CD1-OD2 3.43Å; L214-D280 HydrophobicContact CD2-CB 3.98Å; L214-D280 HydrophobicContact CG-CB 4.47Å; C276-D280 PolarHBondContact O-N 3.16Å; D280-G282 VanDerWaalsContact C-N 3.29Å; D280-G282 PolarHBondContact O-N 3.45Å; D280-Q283 WeakPolarHBondContact O-CB 3.45Å; D280-Q283 PolarHBondContact O-N 3.36Å; D280-Q284 WeakPolarHBondContact O-CG 3.47Å; D280-Q284 PolarHBondContact O-N 3.12Å; D280-Q284 PolarHBondContact OD2-NE2 3.15Å |
| 281 | R | 83.9 | Confident | 80.6 | Confident | 158 Ų | 158 | 92.4 Ų | 92.4 | 60% | 0.596 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -56.2 | -44 | 174.7 | -72.5 | 179.3 | -177.9 | -178.8 | 2.5 | 111.7 | M277 I279 Q283 Q284 F285 | M277-R281 WeakPolarHBondContact O-CG 3Å; M277-R281 PolarHBondContact O-N 3.44Å; I279-R281 PolarHBondContact O-N 2.94Å; R281-Q283 VanDerWaalsContact C-N 3.32Å; R281-Q283 PolarHBondContact O-N 3.16Å; R281-Q284 PolarHBondContact O-N 3.44Å; R281-F285 WeakPolarHBondContact O-CD2 3.32Å; R281-F285 PolarHBondContact O-N 3.04Å |
| 282 | G | 83.7 | Confident | 78.6 | Confident | 41 Ų | 41 | 96 Ų | 96 | 42% | 0.423 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.6 | -38.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | K278 I279 D280 F285 S286 | K278-G282 PolarHBondContact O-N 2.98Å; K278-G282 VanDerWaalsContact O-N 3.1Å; I279-G282 PolarHBondContact O-N 3.07Å; D280-G282 VanDerWaalsContact C-N 3.29Å; D280-G282 PolarHBondContact O-N 3.45Å; G282-F285 PolarHBondContact O-N 3.11Å; G282-S286 PolarHBondContact O-N 3.25Å; G282-S286 VanDerWaalsContact O-N 3.07Å |
| 283 | Q | 80.9 | Confident | 76.5 | Confident | 102 Ų | 102 | 97.2 Ų | 97.2 | 48% | 0.477 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -69.6 | -37.2 | 178.7 | -169.6 | 170.9 | -4.9 | 0 | 0 | 112.5 | I279 D280 R281 S286 R287 | I279-Q283 PolarHBondContact O-N 3.13Å; D280-Q283 WeakPolarHBondContact O-CB 3.45Å; D280-Q283 PolarHBondContact O-N 3.36Å; R281-Q283 VanDerWaalsContact C-N 3.32Å; R281-Q283 PolarHBondContact O-N 3.16Å; Q283-S286 PolarHBondContact O-N 3.47Å; Q283-R287 PolarHBondContact O-N 3.29Å; Q283-R287 VanDerWaalsContact O-N 3.16Å |
| 284 | Q | 76.5 | Confident | 74.5 | Confident | 121 Ų | 121 | 103.4 Ų | 103.4 | 57% | 0.565 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -61.9 | -45.3 | 173.8 | -68.4 | -176.8 | 6.9 | 0 | 0 | 111.7 | D280 R281 R287 S288 | D280-Q284 WeakPolarHBondContact O-CG 3.47Å; D280-Q284 PolarHBondContact O-N 3.12Å; D280-Q284 PolarHBondContact OD2-NE2 3.15Å; R281-Q284 PolarHBondContact O-N 3.44Å; Q284-R287 PolarHBondContact O-N 3.26Å; Q284-S288 PolarHBondContact O-N 3.38Å |
| 285 | F | 72.9 | Confident | 72.6 | Confident | 163 Ų | 163 | 106.2 Ų | 106.2 | 72% | 0.715 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.3 | -38.6 | 177.3 | -71.5 | -65.3 | 0 | 0 | 0 | 112.9 | R281 G282 R287 S288 | R281-F285 WeakPolarHBondContact O-CD2 3.32Å; R281-F285 PolarHBondContact O-N 3.04Å; G282-F285 PolarHBondContact O-N 3.11Å; F285-R287 PolarHBondContact O-N 3.27Å; F285-S288 PolarHBondContact O-N 3.4Å |
| 286 | S | 67.7 | Low | 70.8 | Confident | 92 Ų | 92 | 111.1 Ų | 111.1 | 64% | 0.643 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -69.2 | -30.8 | 179.8 | -173.7 | 0 | 0 | 0 | 0 | 113.3 | G282 Q283 | G282-S286 PolarHBondContact O-N 3.25Å; G282-S286 VanDerWaalsContact O-N 3.07Å; Q283-S286 PolarHBondContact O-N 3.47Å |
| 287 | R | 61.1 | Low | 69.1 | Low | 194 Ų | 194 | 115.1 Ų | 115.1 | 73% | 0.732 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -73.6 | -30.4 | 177.9 | -86.1 | -176 | 169.5 | -179 | -1.4 | 112.8 | Q283 Q284 F285 A289 | Q283-R287 PolarHBondContact O-N 3.29Å; Q283-R287 VanDerWaalsContact O-N 3.16Å; Q284-R287 PolarHBondContact O-N 3.26Å; F285-R287 PolarHBondContact O-N 3.27Å; R287-A289 VanDerWaalsContact C-N 3.28Å; R287-A289 PolarHBondContact O-N 3.42Å |
| 288 | S | 60.1 | Low | 67.6 | Low | 106 Ų | 106 | 125.3 Ų | 125.3 | 74% | 0.741 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -11.9 | -178.5 | -162.2 | 0 | 0 | 0 | 0 | 114.4 | Q284 F285 | Q284-S288 PolarHBondContact O-N 3.38Å; F285-S288 PolarHBondContact O-N 3.4Å |
| 289 | A | 59.7 | Low | 66.4 | Low | 94 Ų | 94 | 127.5 Ų | 127.5 | 78% | 0.777 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92 | -0.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | R287 | R287-A289 VanDerWaalsContact C-N 3.28Å; R287-A289 PolarHBondContact O-N 3.42Å |
| 290 | G | 59.3 | Low | 65.7 | Low | 61 Ų | 61 | 133 Ų | 133 | 63% | 0.629 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -114.2 | -8.9 | -162.8 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||
| 291 | N | 52.8 | Low | 65.1 | Low | 153 Ų | 153 | 140 Ų | 140 | 82% | 0.818 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -132.9 | 131.2 | -175.1 | -114.5 | 4 | 0 | 0 | 0 | 111.4 | ||
| 292 | E | 55.4 | Low | 64.9 | Low | 200 Ų | 200 | 143.7 Ų | 143.7 | 94% | 0.935 | 73% | 0.731 | S | S | * | * | S | Bend | trans | 78.5 | 63.1 | 177.9 | -64.9 | 174.1 | 148.2 | 0 | 0 | 116 | ||
| 293 | G | 54.3 | Low | 64.8 | Low | 71 Ų | 71 | 149.3 Ų | 149.3 | 73% | 0.732 | 75% | 0.75 | S | S | * | * | trans | -152 | 55.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | S295 | G293-S295 PolarHBondContact O-N 3.1Š| ||
| 294 | D | 53.5 | Low | 64.7 | Low | 130 Ų | 130 | 149.9 Ų | 149.9 | 70% | 0.695 | 76% | 0.762 | S | S | * | * | trans | 17.7 | 99.4 | 150.3 | -159.7 | 5.2 | 0 | 0 | 0 | 116 | Q296 | D294-Q296 PolarHBondContact O-N 2.79Š| ||
| 295 | S | 55.6 | Low | 64.9 | Low | 123 Ų | 123 | 153.5 Ų | 153.5 | 86% | 0.86 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | 50.4 | 176.8 | 45.7 | 0 | 0 | 0 | 0 | 113.5 | G293 | G293-S295 PolarHBondContact O-N 3.1Š|
| 296 | Q | 58 | Low | 65.4 | Low | 164 Ų | 164 | 153.5 Ų | 153.5 | 77% | 0.766 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.8 | -2.5 | 179.7 | -73.8 | -144.9 | -25.3 | 0 | 0 | 117 | D294 | D294-Q296 PolarHBondContact O-N 2.79Š|
| 297 | N | 56.3 | Low | 66.2 | Low | 113 Ų | 113 | 157.9 Ų | 157.9 | 60% | 0.604 | 79% | 0.793 | S | S | * | * | trans | -142 | 37.6 | -177.9 | -138.2 | -4.2 | 0 | 0 | 0 | 115.8 | R299 | N297-R299 PolarHBondContact O-N 2.88Å; N297-R299 VanDerWaalsContact OD1-CG 3.27Å; N297-R299 WeakPolarHBondContact OD1-CG 3.46Å; N297-R299 PolarHBondContact OD1-NE 2.86Å; N297-R299 VanDerWaalsContact OD1-NE 3.1Å | ||
| 298 | R | 60.8 | Low | 67.3 | Low | 246 Ų | 246 | 156.3 Ų | 156.3 | 93% | 0.928 | 80% | 0.799 | S | S | * | * | trans | -73.2 | 75.4 | 158.5 | -82 | -170.9 | 170.2 | -170.3 | -2 | 109.3 | R300 | R298-R300 PolarHBondContact O-N 2.91Š| ||
| 299 | R | 68.1 | Low | 68.4 | Low | 184 Ų | 184 | 159.8 Ų | 159.8 | 69% | 0.694 | 80% | 0.8 | S | S | * | * | trans | -54.5 | 103.7 | 162.8 | -64.6 | -179.5 | 178.9 | -175 | -4.9 | 106.5 | N297 F301 | N297-R299 PolarHBondContact O-N 2.88Å; N297-R299 VanDerWaalsContact OD1-CG 3.27Å; N297-R299 WeakPolarHBondContact OD1-CG 3.46Å; N297-R299 PolarHBondContact OD1-NE 2.86Å; N297-R299 VanDerWaalsContact OD1-NE 3.1Å; R299-F301 VanDerWaalsContact C-N 3.31Å; R299-F301 WeakPolarHBondContact O-CD2 3.27Å; R299-F301 PolarHBondContact O-N 2.89Å | ||
| 300 | R | 72.8 | Confident | 69.6 | Low | 234 Ų | 234 | 166.3 Ų | 166.3 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | trans | -61.4 | 99.7 | 169.7 | -70.5 | 179.7 | 178.8 | -174.7 | -0.6 | 106.1 | R298 R302 | R298-R300 PolarHBondContact O-N 2.91Å; R300-R302 VanDerWaalsContact C-N 3.35Å; R300-R302 PolarHBondContact O-N 3.29Å | ||
| 301 | F | 74.6 | Confident | 70.7 | Confident | 191 Ų | 191 | 172.7 Ų | 172.7 | 84% | 0.838 | 82% | 0.816 | S | S | * | * | trans | -58.3 | 103 | 168.9 | -72 | -84.1 | 0 | 0 | 0 | 106.8 | R299 L303 | R299-F301 VanDerWaalsContact C-N 3.31Å; R299-F301 WeakPolarHBondContact O-CD2 3.27Å; R299-F301 PolarHBondContact O-N 2.89Å; F301-L303 PolarHBondContact O-N 3.39Å | ||
| 302 | R | 78 | Confident | 71.6 | Confident | 235 Ų | 235 | 176.4 Ų | 176.4 | 89% | 0.887 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 118.1 | 169.5 | -71.1 | -169.8 | 176.2 | -171.5 | -0.1 | 106.1 | R300 | R300-R302 VanDerWaalsContact C-N 3.35Å; R300-R302 PolarHBondContact O-N 3.29Å |
| 303 | L | 81.6 | Confident | 72.5 | Confident | 159 Ų | 159 | 175.2 Ų | 175.2 | 83% | 0.832 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 128.8 | 171.4 | -109.2 | 80.1 | 0 | 0 | 0 | 108.6 | F301 K305 | F301-L303 PolarHBondContact O-N 3.39Å; L303-K305 PolarHBondContact O-N 3.36Å |
| 304 | P | 79.2 | Confident | 73.4 | Confident | 113 Ų | 113 | 180.7 Ų | 180.7 | 73% | 0.734 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 133.6 | 171.1 | -23.3 | 33.1 | 0 | 0 | 0 | 110 | L306 | P304-L306 PolarHBondContact O-N 3.18Å; P304-L306 VanDerWaalsContact O-N 3.12Å |
| 305 | K | 81.8 | Confident | 74.5 | Confident | 197 Ų | 197 | 183.5 Ų | 183.5 | 86% | 0.857 | 84% | 0.843 | S | S | * | * | trans | -67.5 | 110.3 | 176.1 | -68.4 | 179.3 | -179.7 | 178.6 | 0 | 108.4 | L303 E307 | L303-K305 PolarHBondContact O-N 3.36Å; K305-E307 PolarHBondContact O-N 3.28Å | ||
| 306 | L | 83.4 | Confident | 75.6 | Confident | 164 Ų | 164 | 187.1 Ų | 187.1 | 86% | 0.859 | 84% | 0.842 | S | S | * | * | trans | -75 | 105.5 | 169.7 | -69.8 | 168.7 | 0 | 0 | 0 | 108.3 | P304 L308 | P304-L306 PolarHBondContact O-N 3.18Å; P304-L306 VanDerWaalsContact O-N 3.12Å; L306-L308 PolarHBondContact O-N 3.24Å | ||
| 307 | E | 83 | Confident | 76.7 | Confident | 184 Ų | 184 | 188.5 Ų | 188.5 | 86% | 0.86 | 85% | 0.847 | S | S | * | * | trans | -78.5 | 109.6 | 169.1 | -65.8 | -170.6 | 171 | 0 | 0 | 108.7 | K305 K309 | K305-E307 PolarHBondContact O-N 3.28Å; E307-K309 PolarHBondContact O-N 3.36Å; E307-K309 VanDerWaalsContact O-N 3.15Å | ||
| 308 | L | 84.7 | Confident | 78.1 | Confident | 161 Ų | 161 | 193.5 Ų | 193.5 | 84% | 0.843 | 86% | 0.863 | S | S | * | * | trans | -68.3 | 111.3 | 173 | -70.9 | 167.9 | 0 | 0 | 0 | 108.6 | L306 R310 | L306-L308 PolarHBondContact O-N 3.24Å; L308-R310 PolarHBondContact O-N 3.09Å; L308-R310 VanDerWaalsContact O-N 3.11Å | ||
| 309 | K | 83.9 | Confident | 79.3 | Confident | 179 Ų | 179 | 189.8 Ų | 189.8 | 78% | 0.778 | 86% | 0.859 | S | S | * | * | trans | -59.5 | 113.2 | 174.6 | -161.8 | 169.4 | -175.3 | 175 | 0 | 108.4 | E307 F311 | E307-K309 PolarHBondContact O-N 3.36Å; E307-K309 VanDerWaalsContact O-N 3.15Å; K309-F311 PolarHBondContact O-N 3.11Å | ||
| 310 | R | 84.6 | Confident | 80.2 | Confident | 230 Ų | 230 | 190.2 Ų | 190.2 | 87% | 0.868 | 87% | 0.871 | S | S | * | * | trans | -67.8 | 117.9 | 173.6 | -65.5 | -175.8 | -178.3 | -174 | 0.2 | 107.6 | L308 N312 | L308-R310 PolarHBondContact O-N 3.09Å; L308-R310 VanDerWaalsContact O-N 3.11Å; R310-N312 PolarHBondContact O-N 3.43Å | ||
| 311 | F | 81.5 | Confident | 80.8 | Confident | 195 Ų | 195 | 186.6 Ų | 186.6 | 86% | 0.855 | 87% | 0.87 | S | S | * | * | trans | -75.5 | 115.2 | 168.5 | -65.8 | -88 | 0 | 0 | 0 | 107 | K309 | K309-F311 PolarHBondContact O-N 3.11Š| ||
| 312 | N | 73.6 | Confident | 81.4 | Confident | 231 Ų | 231 | 186.2 Ų | 186.2 | 100% | 1.235 | 87% | 0.873 | S | S | * | * | trans | -74.5 | 0 | 166 | -77.4 | -20.6 | 0 | 0 | 0 | 109.6 | R310 | R310-N312 PolarHBondContact O-N 3.43Š|
Retrieved 312 of 312 residues in 987.5 ms
(Link to these results)